data_2loj_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 2loj _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.59 0.233 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.98 155.4 20.94 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 124.299 0.999 . . . . 0.0 109.243 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -108.49 23.32 14.7 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.511 ' HG3' HG13 ' A' ' 28' ' ' VAL . 17.6 tpp180 -88.55 95.98 10.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.375 0.67 . . . . 0.0 110.721 -176.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.57 90.22 4.52 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.863 0.465 . . . . 0.0 110.038 174.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.511 HG13 ' HG3' ' A' ' 26' ' ' ARG . 16.4 m -103.28 152.78 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.628 0.771 . . . . 0.0 109.438 170.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -62.02 157.13 19.49 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.583 0.753 . . . . 0.0 111.73 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 31.5 t -44.44 -40.59 5.62 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.962 1.705 . . . . 0.0 115.278 -174.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -64.22 -27.68 69.22 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 118.356 0.525 . . . . 0.0 111.44 -175.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.78 30.86 3.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.338 1.055 . . . . 0.0 111.007 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -48.3 -27.7 2.68 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.088 1.355 . . . . 0.0 114.439 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.6 mt -132.03 -53.27 0.98 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 -146.55 50.42 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.848 -172.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.31 -2.85 8.62 Favored 'Trans proline' 0 C--N 1.371 1.726 0 C-N-CA 122.582 2.188 . . . . 0.0 112.376 168.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -80.74 -60.1 2.43 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 123.822 0.849 . . . . 0.0 110.394 -176.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.28 -28.85 12.25 Favored Glycine 0 C--N 1.349 1.259 0 CA-C-O 119.662 -0.521 . . . . 0.0 114.37 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -134.43 95.42 3.38 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.109 0.954 . . . . 0.0 111.387 -177.304 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -143.11 161.36 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.396 0.678 . . . . 0.0 110.037 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 34.4 mt -89.72 124.83 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 C-N-CA 123.183 0.593 . . . . 0.0 109.62 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.524 HG21 ' HA ' ' A' ' 30' ' ' SER . 1.3 mp -81.86 119.45 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 C-N-CA 125.135 1.374 . . . . 0.0 109.438 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -96.24 109.44 21.92 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 175.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 49.6 t-80 -165.35 148.28 8.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.9 0.88 . . . . 0.0 109.872 -174.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.8 t30 69.04 23.48 6.54 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.396 1.079 . . . . 0.0 111.142 171.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.48 24.32 76.19 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.909 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -138.6 177.98 7.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.855 1.262 . . . . 0.0 109.494 -175.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -134.32 149.34 50.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.765 0.826 . . . . 0.0 108.866 169.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.656 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 3.6 p90 -158.84 125.59 4.71 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.493 0.717 . . . . 0.0 111.159 176.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -75.24 115.83 15.31 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.184 0.994 . . . . 0.0 109.843 -172.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 59' ' ' LEU . 55.7 tp -109.97 124.39 51.34 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 8.0 ptm180 -129.93 152.21 49.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.027 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.549 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.0 mtpm? -90.56 108.31 19.72 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 168.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 p -72.57 136.63 45.85 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -60.25 -27.23 67.06 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.177 0.991 . . . . 0.0 112.218 -174.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.46 -22.79 55.85 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.186 0.994 . . . . 0.0 112.039 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.51 41.31 0.96 Allowed Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.626 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -137.01 172.68 12.65 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.318 0.58 . . . . 0.0 111.79 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.502 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.8 mt -106.84 148.26 28.74 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.158 169.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.9 tp -137.92 99.59 3.94 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -89.69 122.47 32.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 177.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.6 p -135.16 131.66 37.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.615 0.766 . . . . 0.0 109.766 -174.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HD2' ' HB3' ' A' ' 49' ' ' TYR . 30.3 mmmt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.261 1.024 . . . . 0.0 108.701 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.462 ' HB2' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 120.87 0.367 . . . . 0.0 111.488 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.39 159.04 19.22 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.798 1.239 . . . . 0.0 108.95 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.436 ' HA ' HD13 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -114.12 22.49 13.79 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.311 0.577 . . . . 0.0 109.865 171.408 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.403 ' HG3' HG11 ' A' ' 28' ' ' VAL . 10.2 tpp180 -85.47 103.22 14.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.11 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -79.75 107.82 12.82 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.403 HG11 ' HG3' ' A' ' 26' ' ' ARG . 22.5 m -122.56 153.17 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 169.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -62.75 164.75 7.4 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.968 0.507 . . . . 0.0 111.932 -174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.2 m -55.35 -33.76 63.66 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.934 0.894 . . . . 0.0 112.916 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.87 -32.47 69.51 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.155 0.982 . . . . 0.0 111.776 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -105.04 31.25 4.96 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.576 1.15 . . . . 0.0 111.443 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.448 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.5 pt? -45.51 -24.64 0.34 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -174.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.537 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 82.4 mt -123.05 -58.52 1.64 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.658 0.663 . . . . 0.0 111.227 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.71 -155.36 46.57 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 123.849 0.718 . . . . 0.0 112.906 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -73.64 -16.03 24.11 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 123.023 2.482 . . . . 0.0 112.001 172.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -79.63 -54.51 5.81 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.27 1.028 . . . . 0.0 110.73 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.537 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 82.47 3.48 90.51 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.482 -171.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.462 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -147.96 89.58 1.75 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.203 1.001 . . . . 0.0 110.009 -177.26 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 m -145.35 170.8 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.787 0.835 . . . . 0.0 110.537 -176.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.436 HD13 ' HA ' ' A' ' 25' ' ' GLU . 26.0 mt -94.33 112.31 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 123.409 0.683 . . . . 0.0 109.913 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -70.8 115.89 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.754 1.621 . . . . 0.0 110.476 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.44 104.05 16.22 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 171.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -102.63 86.53 2.79 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 168.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.0 m120 55.08 55.46 7.63 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.175 1.39 . . . . 0.0 111.329 176.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.9 -26.33 13.25 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.682 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.37 106.05 13.93 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 10.2 pt-20 -101.8 124.48 47.52 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.211 0.604 . . . . 0.0 111.443 -171.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.641 ' HB3' ' HB3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.32 135.34 38.82 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.914 0.886 . . . . 0.0 109.633 178.192 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -78.26 129.55 35.2 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.585 HD11 ' HB3' ' A' ' 59' ' ' LEU . 61.0 tp -122.98 136.63 54.93 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -141.09 142.63 34.11 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.365 0.416 . . . . 0.0 111.796 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -78.69 102.83 8.25 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.348 0.659 . . . . 0.0 109.497 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -73.47 133.75 43.74 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -70.47 -8.25 49.63 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 124.011 0.82 . . . . 0.0 110.702 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.92 -18.29 59.77 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.562 1.145 . . . . 0.0 111.718 167.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.51 34.35 3.89 Favored Glycine 0 C--N 1.344 0.973 0 C-N-CA 123.414 0.53 . . . . 0.0 112.74 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -144.08 175.22 10.21 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.334 0.588 . . . . 0.0 111.47 -175.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.585 ' HB3' HD11 ' A' ' 51' ' ' LEU . 30.8 mt -106.86 146.97 30.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.751 1.221 . . . . 0.0 108.858 165.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -132.86 102.23 5.56 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.407 0.683 . . . . 0.0 109.203 -175.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -88.94 103.23 15.84 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 43.8 p -109.03 135.02 50.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.674 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.641 ' HB3' ' HB3' ' A' ' 49' ' ' TYR . 22.6 pttm . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 123.65 0.78 . . . . 0.0 110.326 -176.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.54 149.55 9.87 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.161 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.476 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 35.0 mt-10 -100.45 28.53 4.97 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.962 0.905 . . . . 0.0 111.325 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -81.06 92.52 6.24 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.486 0.714 . . . . 0.0 111.099 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.476 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 11.1 mpt_? -74.48 106.77 6.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 174.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 m -140.5 145.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.782 1.233 . . . . 0.0 109.374 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -60.95 159.95 10.58 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 -178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.2 m -43.03 -30.43 0.43 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 174.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -55.49 -42.64 74.69 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.488 0.661 . . . . 0.0 111.175 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.94 37.54 1.94 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.557 1.143 . . . . 0.0 110.841 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.587 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -54.33 -22.46 12.18 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.534 HD13 ' HD2' ' A' ' 53' ' ' LYS . 96.0 mt -134.65 -52.53 0.81 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.253 0.549 . . . . 0.0 109.554 174.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.67 -152.26 50.33 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.024 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.35 3.8 6.7 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.83 2.353 . . . . 0.0 112.837 170.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.13 -58.16 2.56 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.595 0.758 . . . . 0.0 109.873 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.55 -22.91 29.55 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.364 -0.686 . . . . 0.0 113.779 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -133.67 101.27 5.05 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-N 118.493 1.147 . . . . 0.0 111.276 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.4 m -142.07 167.83 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 121.816 -0.552 . . . . 0.0 111.335 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.416 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 59.8 mt -92.68 111.62 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.47 1.108 . . . . 0.0 108.868 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.587 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -80.77 111.24 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.162 0.985 . . . . 0.0 109.663 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -89.11 122.13 32.12 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.885 1.274 . . . . 0.0 107.935 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -171.48 143.55 1.8 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.276 0.63 . . . . 0.0 110.723 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.0 t30 62.92 21.34 12.81 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 124.696 1.198 . . . . 0.0 112.18 170.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.06 -4.49 78.01 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 121.872 -0.517 . . . . 0.0 113.527 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -120.26 171.7 8.31 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.718 0.771 . . . . 0.0 111.512 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.416 ' HB2' ' CG2' ' A' ' 41' ' ' ILE . 1.0 OUTLIER -129.82 137.73 50.62 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.294 179.556 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.503 ' HD1' ' HE3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -137.18 118.1 14.23 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.513 0.725 . . . . 0.0 109.087 -178.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -76.5 103.41 6.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.426 0.69 . . . . 0.0 109.235 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.461 HD13 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -104.68 118.74 37.33 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -123.85 134.51 53.57 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 123.764 0.665 . . . . 0.0 109.859 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.624 ' HZ2' ' HB3' ' A' ' 53' ' ' LYS . 9.6 mtpm? -79.31 99.25 7.02 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 173.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -62.69 136.62 57.97 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 176.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -70.42 -4.83 24.42 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.636 0.774 . . . . 0.0 111.704 -177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.35 -11.84 60.17 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.57 1.148 . . . . 0.0 112.071 166.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.58 40.07 5.13 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 123.539 0.59 . . . . 0.0 112.289 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -140.89 170.84 14.99 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.87 0.468 . . . . 0.0 110.726 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.461 ' HB3' HD13 ' A' ' 51' ' ' LEU . 72.1 mt -106.78 139.73 40.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.479 1.112 . . . . 0.0 109.498 172.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -127.12 100.95 6.32 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.82 113.79 25.41 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.5 p -130.31 -179.12 5.07 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.972 1.309 . . . . 0.0 108.17 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.503 ' HE3' ' HD1' ' A' ' 49' ' ' TYR . 46.1 mmtm . . . . . 0 C--O 1.251 1.168 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 CA-C-O 120.896 0.379 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.63 149.23 26.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.841 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.43 24.13 13.17 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.721 0.808 . . . . 0.0 109.366 171.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -83.31 90.24 7.11 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.177 0.991 . . . . 0.0 110.123 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -77.58 96.49 4.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.2 m -119.99 156.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.431 1.092 . . . . 0.0 109.198 171.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -59.27 155.74 13.83 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.941 0.896 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.414 ' HA ' HG21 ' A' ' 42' ' ' ILE . 22.8 t -51.93 -26.81 11.15 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.584 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.6 -35.83 73.05 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.445 0.698 . . . . 0.0 111.701 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.71 40.63 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.946 0.898 . . . . 0.0 109.908 177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -47.17 -16.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 177.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.518 HD12 ' HD2' ' A' ' 53' ' ' LYS . 97.1 mt -119.17 -32.18 4.48 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 121.728 -0.608 . . . . 0.0 110.636 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.25 -166.26 37.89 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.958 -177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.21 -10.32 19.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 122.631 2.22 . . . . 0.0 112.097 173.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -91.65 -24.12 19.63 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.785 0.834 . . . . 0.0 110.625 -175.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.46 -6.29 73.6 Favored Glycine 0 C--N 1.35 1.357 0 O-C-N 123.165 0.291 . . . . 0.0 112.592 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.63 110.2 3.8 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.136 0.974 . . . . 0.0 108.956 -177.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.2 m -146.75 171.89 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.448 0.699 . . . . 0.0 110.742 -176.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.6 mt -92.54 116.12 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.457 171.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.46 136.11 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 125.21 1.404 . . . . 0.0 109.505 174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -115.03 118.34 33.13 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 124.406 1.082 . . . . 0.0 108.404 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -152.45 113.81 4.27 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.458 0.473 . . . . 0.0 111.065 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 t30 63.54 28.9 15.34 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.821 1.248 . . . . 0.0 111.044 171.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.51 2.55 87.15 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.452 -0.794 . . . . 0.0 114.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.479 ' HB2' ' HH ' ' A' ' 49' ' ' TYR . 81.4 mm-40 -111.02 128.57 55.9 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.838 0.855 . . . . 0.0 109.086 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.457 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 15.4 pt-20 -113.02 137.82 50.82 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.284 0.634 . . . . 0.0 110.957 -175.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.479 ' HH ' ' HB2' ' A' ' 47' ' ' GLN . 0.2 OUTLIER -135.31 149.53 49.78 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.348 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -100.35 109.51 21.69 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.854 0.752 . . . . 0.0 109.071 177.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.487 HD12 ' HB3' ' A' ' 59' ' ' LEU . 51.0 tp -107.34 125.85 51.72 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.09 135.66 48.48 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 123.915 0.76 . . . . 0.0 110.54 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HD2' HD12 ' A' ' 34' ' ' LEU . 62.0 mtpt -77.01 108.01 9.77 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -72.29 139.53 48.07 Favored 'General case' 0 C--O 1.249 1.039 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -74.07 -4.72 37.24 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.7 0.625 . . . . 0.0 111.015 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.8 -23.85 67.37 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 110.789 165.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.1 36.99 2.05 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.349 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -134.12 177.66 7.57 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.313 0.578 . . . . 0.0 111.413 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.487 ' HB3' HD12 ' A' ' 51' ' ' LEU . 89.6 mt -114.07 138.86 49.84 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.135 1.374 . . . . 0.0 108.35 169.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -133.28 102.27 5.49 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -174.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -86.06 121.8 29.18 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.9 p -130.49 158.62 39.44 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.996 0.918 . . . . 0.0 109.643 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 124.157 0.983 . . . . 0.0 109.01 -177.777 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.58 -172.72 2.51 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 124.446 1.092 . . . . 0.0 110.398 175.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.25 27.17 8.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.323 1.049 . . . . 0.0 109.95 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.4 ' HG3' HG11 ' A' ' 28' ' ' VAL . 18.7 tpp180 -72.63 76.64 1.09 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.255 1.022 . . . . 0.0 109.524 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.437 ' HA ' ' HB ' ' A' ' 41' ' ' ILE . 2.7 ttm180 -82.91 86.23 6.99 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -171.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.4 HG11 ' HG3' ' A' ' 26' ' ' ARG . 35.5 m -113.67 154.0 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.227 1.011 . . . . 0.0 109.763 -175.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.39 152.08 11.97 Favored 'General case' 0 CA--C 1.555 1.168 0 O-C-N 123.716 0.635 . . . . 0.0 111.042 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -50.04 -24.98 2.98 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -58.22 -33.4 69.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.729 0.412 . . . . 0.0 111.587 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.48 35.3 3.12 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.456 1.102 . . . . 0.0 110.401 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.401 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.7 pt? -53.62 -19.01 3.4 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' ' 53' ' ' LYS . 96.0 mt -133.11 -65.91 0.68 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 168.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.0 -155.29 53.15 Favored Glycine 0 CA--C 1.533 1.188 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.465 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -80.8 2.8 8.28 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 123.035 2.49 . . . . 0.0 112.828 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -97.79 -59.0 1.86 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.342 1.057 . . . . 0.0 109.465 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.27 -11.16 65.5 Favored Glycine 0 C--N 1.347 1.143 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.54 78.74 1.65 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 122.866 1.317 . . . . 0.0 110.868 -175.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.98 159.94 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.773 -168.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.437 ' HB ' ' HA ' ' A' ' 27' ' ' ARG . 50.7 mt -90.15 110.58 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.491 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.35 105.15 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.634 1.174 . . . . 0.0 109.997 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.3 121.7 24.77 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 166.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -145.83 100.3 3.39 Favored 'General case' 0 C--O 1.239 0.537 0 O-C-N 124.038 0.836 . . . . 0.0 109.101 -177.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 61.61 23.24 13.58 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.152 1.381 . . . . 0.0 111.641 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.79 -22.35 40.0 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.653 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -80.92 111.56 17.5 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.5 pt-20 -104.46 131.27 52.03 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.524 0.729 . . . . 0.0 110.222 -175.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.495 ' HD2' HD21 ' A' ' 61' ' ' LEU . 5.6 p90 -148.52 123.86 10.27 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.124 0.57 . . . . 0.0 111.883 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.439 ' HB3' ' HG1' ' A' ' 62' ' ' THR . 3.4 tm? -74.12 110.84 8.74 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.033 1.333 . . . . 0.0 110.061 -175.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' A' ' 59' ' ' LEU . 53.7 tp -104.37 129.41 52.29 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -131.93 133.86 45.01 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.546 0.529 . . . . 0.0 111.255 -174.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HG3' HD23 ' A' ' 34' ' ' LEU . 60.5 mtpt -85.11 105.0 15.51 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.953 0.901 . . . . 0.0 109.491 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.1 p -71.92 145.27 48.59 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -63.3 -20.49 65.53 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 124.708 1.255 . . . . 0.0 112.323 -175.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . 0.407 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . . . -64.77 -15.72 62.03 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.819 0.848 . . . . 0.0 111.767 172.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.93 37.94 4.78 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 124.27 0.938 . . . . 0.0 111.95 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 56' ' ' ALA . 43.9 mtmt -127.64 161.44 28.86 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 120.809 0.337 . . . . 0.0 111.417 -173.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 51' ' ' LEU . 48.3 mt -110.34 126.81 54.63 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.187 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -115.93 114.69 25.0 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.747 1.219 . . . . 0.0 108.82 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.54 HD22 HD11 ' A' ' 51' ' ' LEU . 1.8 tm? -102.36 100.4 10.55 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.439 ' HG1' ' HB3' ' A' ' 50' ' ' LEU . 44.5 p -105.73 152.82 22.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.515 1.126 . . . . 0.0 108.922 171.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 123.13 0.572 . . . . 0.0 109.985 177.857 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -147.43 148.66 31.51 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 166.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -96.61 35.1 1.55 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.4 0.68 . . . . 0.0 109.882 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -95.0 92.23 6.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.823 0.849 . . . . 0.0 110.059 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -80.51 90.63 5.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 121.256 0.55 . . . . 0.0 109.798 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -117.64 157.58 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.158 0.983 . . . . 0.0 109.407 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -48.41 154.65 0.6 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 125.263 1.425 . . . . 0.0 112.813 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.6 m -54.59 -30.6 54.99 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.767 0.827 . . . . 0.0 111.568 170.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -53.52 -41.15 66.07 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.898 0.879 . . . . 0.0 111.683 172.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.65 36.72 2.33 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.837 0.855 . . . . 0.0 110.847 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.41 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -51.44 -21.54 2.43 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 114.671 1.359 . . . . 0.0 114.671 -179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.51 HD11 ' HD2' ' A' ' 53' ' ' LYS . 98.5 mt -123.25 -42.93 2.22 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.29 -157.66 52.59 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.892 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.64 3.69 7.52 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.852 2.368 . . . . 0.0 112.315 173.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -99.76 -54.06 3.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.304 1.042 . . . . 0.0 110.239 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 108.31 -11.34 36.63 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.824 -0.625 . . . . 0.0 114.459 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 pptp? -146.69 111.7 5.38 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 117.887 0.844 . . . . 0.0 110.772 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.8 m -147.06 167.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 124.219 1.008 . . . . 0.0 109.908 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.484 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 58.9 mt -90.75 120.85 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 172.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -79.77 110.17 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 124.897 1.279 . . . . 0.0 110.376 -177.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.93 137.43 34.21 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.673 167.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -160.27 95.69 1.15 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.248 1.019 . . . . 0.0 109.227 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.6 m120 65.06 31.18 11.28 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.3 1.04 . . . . 0.0 111.667 172.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.5 -15.16 62.51 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.999 -0.546 . . . . 0.0 113.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -87.61 142.92 27.47 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.416 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.8 pt-20 -129.31 137.13 50.84 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.564 ' HB3' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -152.41 124.8 8.21 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.487 0.715 . . . . 0.0 110.997 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.484 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -70.82 122.9 20.75 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.524 1.13 . . . . 0.0 109.912 -175.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.2 tp -113.27 127.2 56.08 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 168.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 ptm180 -128.48 135.62 49.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.526 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.8 mtpm? -75.95 99.36 4.51 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 166.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -65.17 138.73 58.45 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.39 -5.7 25.25 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 123.889 0.743 . . . . 0.0 111.57 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.22 -14.63 61.11 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.065 0.946 . . . . 0.0 111.492 165.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 33.29 6.57 Favored Glycine 0 C--N 1.352 1.452 0 C-N-CA 124.061 0.839 . . . . 0.0 112.024 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -137.9 -175.21 4.01 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.96 0.504 . . . . 0.0 110.703 -173.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.473 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.1 mt -112.26 159.07 18.98 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.716 1.206 . . . . 0.0 109.774 171.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.7 tp -147.11 105.92 3.84 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.463 HD22 ' HB2' ' A' ' 51' ' ' LEU . 2.4 tm? -99.6 101.21 12.35 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.0 p -120.11 132.68 55.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.055 0.942 . . . . 0.0 110.031 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.564 ' HG3' ' HB3' ' A' ' 49' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.284 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 171.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 120.388 0.137 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -170.67 141.87 1.92 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.804 0.69 . . . . 0.0 110.349 178.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -94.34 40.33 1.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.343 0.657 . . . . 0.0 110.38 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.469 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.0 tpm_? -91.15 90.69 7.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.067 0.947 . . . . 0.0 109.427 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.66 91.36 5.84 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.469 HG13 ' HG3' ' A' ' 26' ' ' ARG . 22.8 m -107.6 162.87 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.046 0.938 . . . . 0.0 109.172 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -66.13 164.03 16.4 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.859 0.463 . . . . 0.0 111.724 176.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.466 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 41.7 t -57.72 -28.7 64.11 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.388 1.075 . . . . 0.0 112.924 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -59.34 -32.65 70.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.052 0.541 . . . . 0.0 110.674 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.34 40.36 1.78 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.119 0.968 . . . . 0.0 110.117 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.538 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -46.54 -21.45 0.18 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.531 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -122.43 -33.0 3.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.923 0.489 . . . . 0.0 110.651 174.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.51 -152.56 52.36 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.296 -0.724 . . . . 0.0 112.445 -173.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.17 -13.69 12.44 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.667 2.245 . . . . 0.0 112.504 171.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -90.22 -43.0 10.7 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.882 0.873 . . . . 0.0 111.506 -170.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.475 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 94.58 -16.17 61.74 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.065 -171.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.525 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 6.5 ptpp? -130.36 93.28 3.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.736 0.814 . . . . 0.0 110.383 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.8 m -141.66 164.99 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.802 0.841 . . . . 0.0 110.515 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.0 mt -90.17 120.64 39.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.351 0.66 . . . . 0.0 109.243 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.538 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -78.76 132.01 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.032 1.333 . . . . 0.0 109.156 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.17 118.67 34.66 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 172.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 6.1 t-80 -153.43 130.28 10.92 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.726 1.21 . . . . 0.0 110.735 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.63 5.89 88.25 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.414 -0.357 . . . . 0.0 113.064 -172.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -94.51 154.69 17.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.827 0.851 . . . . 0.0 109.753 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.421 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -123.36 131.59 53.7 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.25 0.62 . . . . 0.0 111.008 -171.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -144.98 120.89 10.64 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -80.73 107.19 13.33 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.469 ' HB3' HD11 ' A' ' 42' ' ' ILE . 52.1 tp -103.09 123.62 47.0 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 7.9 ptm180 -128.92 133.47 47.88 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.293 -176.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -79.02 105.81 10.62 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 172.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -70.5 143.64 51.63 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.183 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -73.62 -3.34 27.41 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.867 0.867 . . . . 0.0 112.451 -174.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.83 -7.58 56.85 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.905 0.882 . . . . 0.0 110.912 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.29 37.19 5.69 Favored Glycine 0 C--N 1.35 1.32 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.595 177.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -129.5 166.69 19.14 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 120.987 0.422 . . . . 0.0 111.576 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.451 ' HB3' HD13 ' A' ' 51' ' ' LEU . 56.3 mt -104.7 127.24 52.4 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.137 0.975 . . . . 0.0 108.907 172.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.0 tp -121.0 103.17 8.83 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -88.3 111.84 22.15 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.4 p -122.61 137.69 54.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.435 1.094 . . . . 0.0 108.959 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt . . . . . 0 CA--C 1.554 1.099 0 C-N-CA 123.652 0.781 . . . . 0.0 109.015 -175.961 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 120.732 0.301 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.01 142.39 10.29 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.675 1.19 . . . . 0.0 108.061 167.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.468 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 11.0 pt-20 -90.59 31.89 1.01 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.313 0.577 . . . . 0.0 111.115 178.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -84.14 94.63 8.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.536 1.134 . . . . 0.0 109.646 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.468 ' NH1' ' HB2' ' A' ' 25' ' ' GLU . 8.8 mpt_? -76.42 105.1 7.28 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.7 m -121.86 159.66 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.163 0.985 . . . . 0.0 108.906 170.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.51 155.17 33.73 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.066 0.546 . . . . 0.0 109.661 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -55.33 -20.99 13.2 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.85 1.26 . . . . 0.0 113.714 -175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -56.9 -38.79 73.31 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.382 0.673 . . . . 0.0 110.787 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.87 40.79 1.38 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.131 0.972 . . . . 0.0 110.511 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.425 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -50.21 -18.44 0.59 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 124.792 1.237 . . . . 0.0 114.232 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.24 -57.41 1.49 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.737 0.815 . . . . 0.0 109.488 167.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.27 -154.24 52.41 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.259 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -75.9 -17.56 17.54 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.435 2.09 . . . . 0.0 111.701 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.99 -41.75 73.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.28 1.032 . . . . 0.0 110.462 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.63 -5.81 49.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.795 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.62 105.3 2.42 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.575 1.15 . . . . 0.0 108.745 -178.214 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.8 m -144.22 169.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' TYR . 55.5 mt -90.07 110.87 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 114.353 -1.294 . . . . 0.0 108.63 169.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.513 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.8 132.28 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.208 1.403 . . . . 0.0 109.25 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -105.35 107.68 18.8 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 164.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -123.9 96.6 5.01 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -177.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 t30 60.61 42.44 13.95 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.59 1.156 . . . . 0.0 109.702 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.64 -18.7 28.48 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.82 -1.082 . . . . 0.0 114.072 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -83.96 118.55 24.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.802 0.841 . . . . 0.0 110.289 -176.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -88.56 133.12 34.26 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.799 0.439 . . . . 0.0 110.849 -179.669 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 41' ' ' ILE . 5.5 m-85 -131.14 177.45 7.45 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.78 108.39 9.83 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.53 HD11 ' HB3' ' A' ' 59' ' ' LEU . 47.0 tp -104.41 124.19 48.78 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -125.96 136.94 53.59 Favored 'General case' 0 C--O 1.242 0.67 0 O-C-N 123.482 0.488 . . . . 0.0 110.642 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -79.15 99.12 6.83 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 168.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.8 p -68.62 149.06 49.59 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.748 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.33 -10.36 59.69 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 124.702 1.251 . . . . 0.0 113.218 -169.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.85 -14.34 59.91 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.472 0.709 . . . . 0.0 110.68 170.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.57 43.46 2.31 Favored Glycine 0 C--N 1.352 1.465 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.967 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -134.07 -179.49 5.59 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 116.806 0.303 . . . . 0.0 111.402 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.53 ' HB3' HD11 ' A' ' 51' ' ' LEU . 83.5 mt -124.14 129.41 50.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.844 1.258 . . . . 0.0 109.818 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -123.56 105.1 9.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.674 0.79 . . . . 0.0 109.347 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . 0.519 HD23 ' HB2' ' A' ' 51' ' ' LEU . 3.3 tm? -96.9 100.39 11.92 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.3 p -130.71 135.53 47.9 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.224 1.01 . . . . 0.0 109.617 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 123.94 0.896 . . . . 0.0 109.183 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 121.028 0.442 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.43 161.65 42.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.397 170.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -114.41 22.85 13.32 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.978 0.511 . . . . 0.0 109.987 171.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -77.18 88.61 3.64 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -77.14 87.85 3.61 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 121.803 0.811 . . . . 0.0 110.11 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -116.8 159.32 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 114.46 -1.246 . . . . 0.0 109.347 178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -59.37 161.43 5.65 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.913 0.885 . . . . 0.0 112.248 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.422 ' HA ' HG21 ' A' ' 42' ' ' ILE . 54.9 p -54.41 -30.33 51.92 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.068 0.947 . . . . 0.0 113.377 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -62.65 -30.79 71.63 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.643 0.377 . . . . 0.0 111.728 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.06 34.72 2.93 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.069 0.948 . . . . 0.0 110.661 176.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.467 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -49.48 -17.91 0.35 Allowed 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.526 HD12 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -125.58 -41.92 1.98 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.118 0.567 . . . . 0.0 110.089 174.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.67 -162.89 44.4 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.174 0.921 . . . . 0.0 112.699 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.5 -15.34 34.32 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.549 2.166 . . . . 0.0 112.274 172.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.92 -40.66 46.41 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.06 0.944 . . . . 0.0 111.165 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.51 -6.63 83.09 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.347 -169.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.03 122.05 7.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.497 1.119 . . . . 0.0 109.501 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.2 m -152.33 172.45 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.812 0.845 . . . . 0.0 110.248 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.3 mt -93.39 116.75 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 167.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.483 HD11 ' HB3' ' A' ' 51' ' ' LEU . 1.4 mp -76.32 123.0 31.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 124.596 1.158 . . . . 0.0 109.302 177.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -97.75 122.01 40.33 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -157.94 117.18 3.22 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 123.314 0.646 . . . . 0.0 109.639 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.5 m120 66.88 16.97 10.49 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.78 1.232 . . . . 0.0 111.92 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.39 75.04 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 122.989 0.328 . . . . 0.0 113.069 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -90.46 156.98 17.81 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.751 0.82 . . . . 0.0 110.206 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.23 126.02 38.2 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.742 0.817 . . . . 0.0 109.717 -177.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.7 136.79 27.66 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.178 0.591 . . . . 0.0 109.655 177.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -84.63 123.98 30.95 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.039 0.935 . . . . 0.0 109.301 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' A' ' 59' ' ' LEU . 59.2 tp -119.5 136.8 54.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -139.76 143.83 37.13 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.499 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.527 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.4 mtpm? -83.02 98.99 9.56 Favored 'General case' 0 C--N 1.347 0.478 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.416 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -63.63 139.26 58.75 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -74.0 1.55 10.67 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -175.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.97 -18.79 63.37 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.548 0.739 . . . . 0.0 110.838 164.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.63 33.42 4.15 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.903 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.416 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.6 mtpt -134.94 -178.07 4.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.7 0.8 . . . . 0.0 111.253 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.484 ' HB3' HD11 ' A' ' 51' ' ' LEU . 69.8 mt -108.24 166.46 10.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.312 1.045 . . . . 0.0 109.99 169.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.4 tp -152.33 106.16 3.11 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.39 101.1 13.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -103.91 164.46 11.68 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.244 1.018 . . . . 0.0 108.991 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.255 1.347 0 CA-C-O 118.631 -0.699 . . . . 0.0 109.435 176.912 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -168.07 140.45 3.03 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.079 0.952 . . . . 0.0 109.448 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.36 24.91 4.71 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.619 0.723 . . . . 0.0 109.526 169.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -70.55 78.62 0.58 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.706 1.602 . . . . 0.0 110.143 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -81.36 91.07 6.21 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.755 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 m -122.76 154.13 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.64 1.176 . . . . 0.0 109.565 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -60.33 155.52 17.72 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.558 0.743 . . . . 0.0 111.111 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.494 ' HA ' HG22 ' A' ' 42' ' ' ILE . 48.3 p -51.44 -25.19 5.91 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -66.66 -25.71 66.7 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.422 0.63 . . . . 0.0 111.306 177.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.53 32.99 4.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.709 1.204 . . . . 0.0 110.469 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -50.03 -18.32 0.53 Allowed 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 124.593 1.157 . . . . 0.0 114.09 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.467 HD23 ' HG3' ' A' ' 53' ' ' LYS . 96.1 mt -126.4 -49.55 1.54 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.64 0.776 . . . . 0.0 109.715 170.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.08 -152.96 46.03 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-N 115.563 -0.744 . . . . 0.0 113.589 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.43 -17.0 21.47 Favored 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 122.682 2.255 . . . . 0.0 112.296 173.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -76.73 -38.78 53.66 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.192 0.997 . . . . 0.0 110.222 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.59 -0.24 70.97 Favored Glycine 0 C--N 1.347 1.178 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.953 -171.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.8 106.24 1.08 Allowed 'General case' 0 C--N 1.351 0.673 0 C-N-CA 124.427 1.091 . . . . 0.0 108.861 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.9 m -138.73 169.66 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.919 0.888 . . . . 0.0 110.034 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -91.76 109.02 20.72 Favored 'Isoleucine or valine' 0 C--O 1.243 0.756 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 164.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.494 HG22 ' HA ' ' A' ' 30' ' ' SER . 54.4 mt -61.12 132.41 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.033 0.933 . . . . 0.0 109.694 174.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -116.73 120.8 39.71 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 174.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . 0.406 ' HB2' ' HB3' ' A' ' 30' ' ' SER . 57.0 t60 -160.85 118.26 2.39 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.487 0.315 . . . . 0.0 111.269 -176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 t30 55.65 51.1 13.1 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.178 1.391 . . . . 0.0 111.68 171.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.43 -18.89 12.29 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.317 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -105.39 144.08 32.67 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.52 0.728 . . . . 0.0 110.232 -173.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.0 pt-20 -134.43 138.42 44.78 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.922 0.489 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -151.56 136.2 17.06 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.121 0.968 . . . . 0.0 110.236 -172.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.82 113.31 13.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.707 0.803 . . . . 0.0 109.957 -178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 56.9 tp -104.29 138.8 40.21 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -141.29 146.66 37.06 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 111.058 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.55 ' HZ2' ' HB3' ' A' ' 53' ' ' LYS . 9.4 mtpm? -78.64 107.64 11.46 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 167.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.7 p -67.33 130.07 41.89 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.44 -20.07 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 123.852 0.72 . . . . 0.0 111.148 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.44 -24.57 63.64 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.994 0.918 . . . . 0.0 111.187 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.03 43.03 0.88 Allowed Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.492 173.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -144.62 -174.39 4.31 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.102 0.561 . . . . 0.0 110.486 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.8 mt -116.07 142.93 46.15 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.669 1.188 . . . . 0.0 108.739 169.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -126.74 107.23 9.97 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -90.89 125.92 35.9 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 173.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -141.39 167.74 21.43 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.154 1.382 . . . . 0.0 108.491 -176.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? . . . . . 0 C--O 1.25 1.09 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 172.136 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.08 0.467 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.59 173.54 14.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.879 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.34 38.57 1.55 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 122.012 0.91 . . . . 0.0 109.454 172.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.407 ' NH1' HG13 ' A' ' 40' ' ' VAL . 29.0 ttt180 -82.33 95.75 7.71 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.939 173.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.78 95.01 3.94 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 m -131.36 158.2 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.03 0.932 . . . . 0.0 109.342 175.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -62.09 158.58 16.34 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.134 0.897 . . . . 0.0 110.913 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.5 t -54.12 -22.39 10.97 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.713 1.205 . . . . 0.0 113.813 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -58.39 -38.87 78.22 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.099 0.56 . . . . 0.0 110.915 175.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.03 36.37 2.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.981 0.913 . . . . 0.0 110.596 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.03 -24.12 6.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 124.553 1.141 . . . . 0.0 113.948 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -130.33 -69.52 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.107 0.563 . . . . 0.0 109.653 174.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.26 -161.6 50.15 Favored Glycine 0 CA--C 1.533 1.179 0 O-C-N 123.996 0.81 . . . . 0.0 112.071 -172.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.93 -11.83 31.39 Favored 'Trans proline' 0 C--N 1.37 1.706 0 C-N-CA 122.759 2.306 . . . . 0.0 112.448 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.39 -49.95 61.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.146 0.978 . . . . 0.0 109.662 174.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.47 3.58 78.15 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.877 -1.056 . . . . 0.0 113.36 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -161.62 110.46 1.52 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.239 1.016 . . . . 0.0 108.29 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.407 HG13 ' NH1' ' A' ' 26' ' ' ARG . 3.1 m -147.08 167.53 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 123.013 0.525 . . . . 0.0 110.334 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.1 mt -90.54 108.03 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 166.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.512 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.32 135.25 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.634 1.174 . . . . 0.0 109.41 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -115.69 127.06 54.88 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 124.521 1.128 . . . . 0.0 108.472 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -165.79 123.37 1.48 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.846 0.858 . . . . 0.0 109.688 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 67.3 26.77 8.46 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.588 1.155 . . . . 0.0 110.725 173.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.84 16.24 79.38 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.121 -176.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -114.96 133.67 55.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.061 0.944 . . . . 0.0 108.833 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -116.55 133.22 56.27 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.122 0.969 . . . . 0.0 110.541 -174.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -140.7 125.26 17.86 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -79.64 106.05 11.39 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 59.9 tp -101.99 131.36 48.45 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 173.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -138.4 140.34 39.31 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 123.836 0.71 . . . . 0.0 110.306 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -84.63 112.16 20.2 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 173.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.469 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 9.6 p -74.53 148.22 41.09 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.72 -8.61 44.34 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 124.17 0.919 . . . . 0.0 112.692 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.9 -3.83 37.54 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.591 0.757 . . . . 0.0 111.505 169.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.89 38.91 7.75 Favored Glycine 0 C--N 1.353 1.504 0 C-N-CA 123.355 0.503 . . . . 0.0 112.12 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.469 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 22.8 mtpp -130.97 -178.48 4.84 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.155 0.582 . . . . 0.0 110.675 -174.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.7 mt -111.3 156.24 21.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.46 1.104 . . . . 0.0 109.39 169.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.3 tp -144.76 101.57 3.67 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 176.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -84.56 114.73 22.18 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 174.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.7 p -126.45 154.79 43.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.502 1.121 . . . . 0.0 108.565 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.921 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.01 117.54 1.21 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 123.848 0.717 . . . . 0.0 109.637 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.58 69.58 7.11 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.807 0.843 . . . . 0.0 109.196 173.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -125.67 88.73 2.91 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.594 0.758 . . . . 0.0 109.114 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.1 mtp85 -81.33 90.39 6.14 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.523 0.678 . . . . 0.0 110.375 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.5 m -121.34 157.73 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.758 1.223 . . . . 0.0 109.173 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -64.62 156.93 28.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.569 0.747 . . . . 0.0 110.148 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.8 t -56.41 -20.16 18.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.362 1.065 . . . . 0.0 113.787 -174.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -54.88 -40.85 70.18 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.771 0.828 . . . . 0.0 111.372 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.78 40.31 1.4 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.491 1.116 . . . . 0.0 110.347 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -48.08 -18.53 0.2 Allowed 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.574 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 86.0 mt -117.25 -33.49 4.64 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.538 0.608 . . . . 0.0 110.963 176.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.66 -145.61 45.68 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-O 118.939 -0.923 . . . . 0.0 112.465 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -88.1 -13.41 3.75 Favored 'Trans proline' 0 C--N 1.369 1.64 0 C-N-CA 122.98 2.453 . . . . 0.0 112.92 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -91.72 -29.15 16.98 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.591 0.757 . . . . 0.0 111.538 -173.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.574 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 86.11 0.67 86.99 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -165.101 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -146.46 119.74 8.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.729 1.212 . . . . 0.0 109.197 -176.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.444 HG21 HD11 ' A' ' 42' ' ' ILE . 35.7 m -151.1 171.6 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.137 0.975 . . . . 0.0 109.601 178.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 62.1 mt -91.35 106.54 17.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 168.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.444 HD11 HG21 ' A' ' 40' ' ' VAL . 1.6 mp -68.48 137.08 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 124.726 1.21 . . . . 0.0 109.926 176.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -112.4 126.57 55.43 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 169.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -164.47 140.68 6.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 173.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 66.55 14.76 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.097 1.359 . . . . 0.0 111.442 -175.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.29 -5.38 72.84 Favored Glycine 0 C--N 1.352 1.459 0 C-N-CA 123.329 0.49 . . . . 0.0 112.8 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -95.76 161.46 14.01 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.408 1.083 . . . . 0.0 109.782 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.45 138.52 54.01 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.333 0.653 . . . . 0.0 110.14 -178.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 140.21 26.16 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.04 122.72 30.46 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.477 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -114.07 135.1 54.39 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 167.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -138.86 137.8 36.88 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.505 0.503 . . . . 0.0 111.094 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.596 ' HZ3' ' HB3' ' A' ' 53' ' ' LYS . 9.8 mtpm? -79.01 102.38 8.31 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 169.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.533 ' HG1' ' HB2' ' A' ' 58' ' ' LYS . 24.3 p -65.74 140.28 58.43 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -75.44 -0.59 20.57 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.126 0.489 . . . . 0.0 111.676 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.93 -1.51 22.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.895 0.878 . . . . 0.0 111.236 163.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.32 35.57 8.68 Favored Glycine 0 C--N 1.35 1.356 0 C-N-CA 124.018 0.818 . . . . 0.0 112.571 174.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.533 ' HB2' ' HG1' ' A' ' 54' ' ' THR . 47.3 mtmt -133.96 173.85 11.12 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.667 0.387 . . . . 0.0 111.362 -174.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.6 mt -110.15 136.18 49.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.939 1.295 . . . . 0.0 109.274 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.33 98.7 5.55 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -92.8 104.67 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -115.28 126.78 54.91 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.613 1.165 . . . . 0.0 108.88 175.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.909 -175.972 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HB2' HD11 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.09 163.97 28.34 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.208 0.603 . . . . 0.0 110.735 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.02 24.58 8.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 110.13 172.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -81.28 93.71 6.59 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.919 0.487 . . . . 0.0 110.874 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 102.46 4.43 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.3 m -123.32 157.61 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.705 1.202 . . . . 0.0 108.136 168.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 7.1 p30 -74.03 167.05 22.3 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 122.941 0.151 . . . . 0.0 110.675 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -48.56 -30.94 5.81 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -172.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -62.81 -31.86 72.93 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 118.503 0.592 . . . . 0.0 111.197 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.86 30.07 5.39 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.391 1.077 . . . . 0.0 110.202 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.523 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.6 pt? -48.94 -29.33 4.64 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.523 1.129 . . . . 0.0 113.833 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.523 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 93.3 mt -130.97 -69.92 0.62 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 109.735 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.9 -151.66 52.12 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.932 -174.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.27 -13.66 25.59 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 122.523 2.148 . . . . 0.0 112.437 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.7 -60.49 2.21 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.167 0.987 . . . . 0.0 110.397 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.72 -17.33 45.73 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-N 114.822 -1.081 . . . . 0.0 113.178 -175.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -136.45 99.38 4.07 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.654 0.782 . . . . 0.0 110.108 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.69 165.3 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 124.02 0.928 . . . . 0.0 109.468 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.457 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 54.6 mt -90.19 118.54 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.257 0.623 . . . . 0.0 109.666 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 mp -78.56 131.09 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.972 1.309 . . . . 0.0 110.009 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 12.2 t70 -104.13 122.29 45.01 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 124.894 1.277 . . . . 0.0 107.781 171.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -156.98 110.53 2.61 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.31 0.644 . . . . 0.0 109.366 -175.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 61.65 28.25 17.46 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.155 0.982 . . . . 0.0 111.375 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.54 -9.35 76.15 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.862 -0.608 . . . . 0.0 113.464 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -81.18 138.38 35.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.445 0.698 . . . . 0.0 109.972 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.45 124.75 52.91 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.879 0.871 . . . . 0.0 108.69 177.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.6 125.07 8.23 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.81 0.444 . . . . 0.0 112.054 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.508 HD11 ' HB2' ' A' ' 23' ' ' ALA . 3.2 tm? -77.93 115.54 17.74 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.611 1.165 . . . . 0.0 109.455 -173.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.437 HD11 ' HB3' ' A' ' 59' ' ' LEU . 36.0 tp -104.56 131.17 52.28 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 171.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -134.52 134.31 41.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.043 0.839 . . . . 0.0 110.688 -175.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.551 ' HZ3' ' HB3' ' A' ' 53' ' ' LYS . 9.8 mtpm? -82.74 103.9 12.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.2 p -64.93 144.01 57.57 Favored 'General case' 0 C--O 1.253 1.254 0 O-C-N 123.968 0.793 . . . . 0.0 109.362 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -68.87 -11.63 60.73 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.358 1.063 . . . . 0.0 112.146 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.93 -0.87 17.47 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.933 0.893 . . . . 0.0 111.431 169.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.96 44.53 7.62 Favored Glycine 0 C--N 1.354 1.53 0 C-N-CA 123.585 0.612 . . . . 0.0 112.2 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -139.39 174.97 9.97 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 122.555 0.342 . . . . 0.0 110.748 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.437 ' HB3' HD11 ' A' ' 51' ' ' LEU . 80.9 mt -109.14 135.27 50.55 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.351 1.061 . . . . 0.0 109.957 171.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -125.0 106.34 9.88 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -89.13 100.95 13.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 67.3 p -108.91 159.76 16.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 C--O 1.252 1.191 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.981 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HB3' HD22 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -153.2 143.25 22.24 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.208 -1.36 . . . . 0.0 109.262 172.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -86.3 30.96 0.67 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.467 0.707 . . . . 0.0 111.571 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.454 ' HG3' HG12 ' A' ' 28' ' ' VAL . 7.8 tpp180 -87.96 92.87 9.29 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.097 0.559 . . . . 0.0 109.616 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -79.72 103.76 9.84 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.454 HG12 ' HG3' ' A' ' 26' ' ' ARG . 20.8 m -110.88 154.1 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -52.44 150.13 5.13 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.481 0.712 . . . . 0.0 111.02 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' SER . . . . . 0.513 ' HA ' HG23 ' A' ' 42' ' ' ILE . 15.5 m -47.24 -35.17 7.32 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -58.09 -32.32 67.96 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.902 0.881 . . . . 0.0 112.202 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.66 31.23 4.86 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.284 1.034 . . . . 0.0 111.75 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -46.2 -22.83 0.27 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -125.31 -68.9 0.81 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.472 0.709 . . . . 0.0 109.923 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.78 -153.59 51.54 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 113.457 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -70.5 -16.65 34.46 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.983 2.456 . . . . 0.0 112.247 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.56 -56.64 3.75 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.834 0.854 . . . . 0.0 110.167 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.9 -10.01 64.12 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-N 114.799 -1.091 . . . . 0.0 113.397 -175.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -136.41 73.53 1.46 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.198 0.999 . . . . 0.0 110.708 -175.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 19.6 m -135.88 161.15 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.008 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 35.1 mt -86.83 121.79 38.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.08 -178.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.513 HG23 ' HA ' ' A' ' 30' ' ' SER . 48.8 mt -69.6 105.9 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.798 0.839 . . . . 0.0 109.39 173.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -87.16 121.52 29.73 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 172.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -147.46 95.71 2.58 Favored 'General case' 0 C--O 1.241 0.658 0 O-C-N 123.869 0.731 . . . . 0.0 110.035 -175.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 23.6 m120 58.42 45.15 17.13 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.422 1.089 . . . . 0.0 112.034 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.84 -26.41 6.02 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 113.709 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.71 107.7 15.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -101.42 138.56 38.27 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.641 0.776 . . . . 0.0 109.675 178.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.602 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -147.69 126.43 12.61 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.544 0.737 . . . . 0.0 109.035 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.9 tm? -71.71 126.14 28.94 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.115 0.566 . . . . 0.0 110.382 -174.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.553 HD12 ' HB3' ' A' ' 59' ' ' LEU . 37.0 tp -117.15 119.74 36.15 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 172.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.558 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.9 ptm180 -126.6 136.27 52.31 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.944 0.402 . . . . 0.0 110.616 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -76.36 99.6 4.88 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.5 p -64.39 138.2 58.29 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -72.38 -7.11 47.95 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 124.764 1.29 . . . . 0.0 111.341 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.76 -18.76 62.76 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.888 0.875 . . . . 0.0 111.088 168.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.89 38.33 2.2 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.984 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -140.78 176.75 8.54 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.305 0.574 . . . . 0.0 111.428 -174.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.553 ' HB3' HD12 ' A' ' 51' ' ' LEU . 78.1 mt -108.15 136.58 47.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 109.133 169.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -119.34 103.69 9.71 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -91.42 124.75 35.84 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.6 p -136.72 120.54 17.43 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.1 0.96 . . . . 0.0 108.981 -174.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.602 ' HD3' ' HB3' ' A' ' 49' ' ' TYR . 35.1 mmtp . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.021 0.928 . . . . 0.0 109.819 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.427 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -166.01 114.67 0.95 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.12 0.568 . . . . 0.0 110.76 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.17 100.23 4.22 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-O 121.992 0.901 . . . . 0.0 109.442 175.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -150.61 91.22 1.71 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 108.865 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.74 86.78 3.36 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.447 -176.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.8 m -101.33 167.58 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.451 1.1 . . . . 0.0 108.048 172.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -55.01 149.22 12.19 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.589 0.756 . . . . 0.0 111.343 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 t -58.71 -26.12 63.59 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.33 0.652 . . . . 0.0 111.609 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -60.49 -35.72 76.61 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.757 0.823 . . . . 0.0 110.983 172.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.54 30.54 3.54 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.193 0.997 . . . . 0.0 110.972 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -47.03 -28.44 1.68 Allowed 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.918 1.287 . . . . 0.0 114.324 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.447 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 88.7 mt -121.37 -56.12 1.91 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.499 0.72 . . . . 0.0 109.376 175.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.25 -151.75 50.23 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.333 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.86 -13.13 14.51 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.535 2.157 . . . . 0.0 112.496 172.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.58 -43.44 15.67 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.672 0.789 . . . . 0.0 110.488 -177.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 79.0 4.32 88.66 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.449 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 17.3 ptpt -151.59 75.23 1.16 Allowed 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.756 0.789 . . . . 0.0 110.387 -173.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -141.46 169.6 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.124 -175.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.417 HG21 ' HB2' ' A' ' 48' ' ' GLU . 23.0 mt -91.59 125.08 44.32 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 CA-C-O 121.499 0.666 . . . . 0.0 110.9 -178.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.583 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -62.96 134.8 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.839 1.656 . . . . 0.0 109.464 168.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -114.72 115.52 27.21 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 163.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -126.73 87.23 2.62 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.1 t30 66.66 22.43 10.44 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 124.617 1.167 . . . . 0.0 110.766 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.57 -4.99 56.79 Favored Glycine 0 C--N 1.351 1.416 0 O-C-N 121.772 -0.58 . . . . 0.0 113.333 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -81.55 108.08 14.83 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 9.8 pt-20 -98.25 135.21 40.21 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.477 0.486 . . . . 0.0 111.303 -174.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -145.71 125.9 13.82 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 123.555 0.742 . . . . 0.0 110.021 175.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -78.91 103.18 8.68 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.565 0.62 . . . . 0.0 109.55 176.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.0 tp -96.72 132.33 42.51 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 17.1 ptm180 -138.7 137.75 37.09 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 123.54 0.525 . . . . 0.0 111.214 -175.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -81.47 99.23 8.64 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.43 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 17.1 p -67.7 142.47 56.31 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 123.899 0.749 . . . . 0.0 109.412 -177.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -64.01 -16.35 61.43 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 124.877 1.361 . . . . 0.0 112.004 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.08 -7.63 31.06 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.174 0.99 . . . . 0.0 112.459 171.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.02 42.66 5.9 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.687 0.661 . . . . 0.0 112.007 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.43 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.8 mtpt -140.98 177.84 7.78 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.092 0.557 . . . . 0.0 110.479 -172.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.2 mt -114.24 143.61 44.57 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.646 1.178 . . . . 0.0 109.198 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.518 ' HG ' HG21 ' A' ' 62' ' ' THR . 17.9 tp -132.98 105.32 7.01 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -89.61 102.11 14.79 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' THR . . . . . 0.518 HG21 ' HG ' ' A' ' 60' ' ' LEU . 25.6 p -129.14 123.13 31.34 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.9 0.88 . . . . 0.0 109.913 -175.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 48' ' ' GLU . 24.1 tptp . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HB2' HD21 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.44 118.15 1.91 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.72 1.208 . . . . 0.0 108.518 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -71.05 90.39 0.84 Allowed 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.149 0.58 . . . . 0.0 109.587 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -139.01 84.2 2.0 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.09 0.956 . . . . 0.0 108.883 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -75.94 86.18 2.87 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.341 0.591 . . . . 0.0 110.24 -177.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -109.93 149.11 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 124.468 1.107 . . . . 0.0 108.216 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -51.83 157.87 1.12 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.591 1.156 . . . . 0.0 112.702 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -54.05 -28.05 36.27 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.209 1.004 . . . . 0.0 113.301 179.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -62.12 -34.98 77.36 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.999 0.428 . . . . 0.0 110.654 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.4 35.59 2.08 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.589 1.156 . . . . 0.0 110.695 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -47.71 -21.53 0.39 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.9 mt -130.49 -43.3 1.14 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.256 0.623 . . . . 0.0 109.917 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.63 -158.6 51.21 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.62 -175.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.95 -14.47 15.33 Favored 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 169.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -79.2 -35.42 41.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.878 0.871 . . . . 0.0 111.077 -174.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.0 -11.13 63.35 Favored Glycine 0 C--N 1.352 1.453 0 N-CA-C 114.665 0.626 . . . . 0.0 114.665 171.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.58 85.9 1.45 Allowed 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.054 0.927 . . . . 0.0 110.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -131.58 171.32 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.393 0.677 . . . . 0.0 110.462 -171.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.413 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 32.9 mt -99.91 123.22 52.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 123.183 0.593 . . . . 0.0 109.805 176.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.508 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -73.55 122.7 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 124.896 1.279 . . . . 0.0 109.011 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -93.59 123.03 36.64 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -148.63 96.71 2.63 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.706 0.802 . . . . 0.0 109.959 -177.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.15 30.94 20.83 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.576 1.151 . . . . 0.0 112.15 172.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.11 -22.3 39.89 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-O 119.698 -0.501 . . . . 0.0 113.397 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -83.6 153.53 24.26 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.8 pt-20 -133.92 135.3 43.5 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.166 0.291 . . . . 0.0 110.617 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -135.52 113.9 11.56 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.509 HD21 ' HB2' ' A' ' 23' ' ' ALA . 3.3 tm? -70.21 110.59 5.29 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 175.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.405 HD13 ' HB3' ' A' ' 59' ' ' LEU . 52.4 tp -106.56 118.62 37.13 Favored 'General case' 0 C--O 1.249 1.041 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -123.6 137.05 54.82 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.979 0.512 . . . . 0.0 110.76 -177.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.623 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.0 mtpm? -78.47 99.32 6.39 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 170.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.46 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -69.58 142.84 53.48 Favored 'General case' 0 C--O 1.251 1.174 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -69.44 -10.3 57.39 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.105 0.962 . . . . 0.0 111.602 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.61 -24.41 67.56 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.572 0.749 . . . . 0.0 110.948 167.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.94 37.53 2.71 Favored Glycine 0 C--N 1.35 1.307 0 C-N-CA 124.358 0.98 . . . . 0.0 111.733 -179.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.46 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.9 mtpt -135.02 176.04 9.03 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.444 0.64 . . . . 0.0 111.524 -172.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.405 ' HB3' HD13 ' A' ' 51' ' ' LEU . 49.8 mt -109.58 141.71 41.69 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.035 -1.438 . . . . 0.0 107.405 163.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 tp -131.5 103.08 6.21 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -88.54 113.19 23.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 p -137.63 142.03 41.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.534 1.134 . . . . 0.0 108.884 -175.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 122.972 0.509 . . . . 0.0 109.653 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.99 161.1 41.48 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.402 1.081 . . . . 0.0 108.933 171.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.422 ' O ' ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -111.07 29.59 7.65 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.894 0.854 . . . . 0.0 109.238 168.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -82.25 86.23 6.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.778 0.831 . . . . 0.0 109.947 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -77.15 87.5 3.61 Favored 'General case' 0 C--N 1.36 1.023 0 CA-C-O 121.091 0.472 . . . . 0.0 110.185 177.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.5 m -101.86 154.35 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 173.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -58.6 150.55 22.78 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.097 0.559 . . . . 0.0 109.764 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 p -51.04 -25.05 4.33 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -175.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -56.29 -38.73 71.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.82 0.848 . . . . 0.0 111.506 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.37 36.29 2.19 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.969 0.908 . . . . 0.0 110.777 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.453 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -46.39 -26.26 0.8 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.558 1.543 . . . . 0.0 115.029 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.453 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 97.5 mt -127.38 -54.34 1.36 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 122.824 0.45 . . . . 0.0 110.089 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 -158.46 53.39 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.488 -175.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -78.21 -7.55 16.16 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.372 2.048 . . . . 0.0 112.031 172.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.92 -48.35 13.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.459 1.104 . . . . 0.0 110.467 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.22 -12.9 61.16 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.898 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -142.9 89.46 2.12 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 117.579 0.69 . . . . 0.0 110.761 -177.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.3 m -140.56 163.01 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 123.213 0.605 . . . . 0.0 110.363 -175.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . 0.537 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 25.7 mt -88.49 125.41 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -81.15 119.57 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.246 1.419 . . . . 0.0 109.329 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -103.19 115.4 30.5 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -161.99 142.07 10.15 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.158 0.983 . . . . 0.0 108.729 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . 0.428 ' HB2' HE21 ' A' ' 47' ' ' GLN . 17.6 m-80 70.18 12.61 7.69 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.554 1.542 . . . . 0.0 111.611 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.0 83.09 Favored Glycine 0 C--N 1.345 1.034 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 -170.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.428 HE21 ' HB2' ' A' ' 45' ' ' ASN . 40.6 mt-30 -111.15 158.05 19.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.348 1.059 . . . . 0.0 108.683 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.74 125.86 27.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 122.811 0.444 . . . . 0.0 110.435 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -148.5 126.78 12.21 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 111.273 -174.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 3.3 tm? -75.29 122.74 24.17 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.855 1.262 . . . . 0.0 110.722 -172.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 59' ' ' LEU . 54.9 tp -111.29 127.04 55.5 Favored 'General case' 0 C--O 1.245 0.866 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 167.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.417 ' HD3' HD21 ' A' ' 60' ' ' LEU . 16.9 ptm180 -128.24 142.93 51.02 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.71 0.631 . . . . 0.0 110.564 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.411 ' HD2' HD13 ' A' ' 34' ' ' LEU . 27.5 mtpp -83.59 104.88 14.07 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.717 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.2 p -71.4 134.23 46.5 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 172.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -72.98 -0.64 14.33 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.964 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.15 -14.21 61.76 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.953 0.901 . . . . 0.0 110.715 166.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.82 35.15 4.11 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.501 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -139.42 173.52 11.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.006 0.523 . . . . 0.0 111.289 -174.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.486 ' HB3' HD13 ' A' ' 51' ' ' LEU . 59.7 mt -111.26 144.42 40.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.301 1.04 . . . . 0.0 109.242 174.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . 0.417 HD21 ' HD3' ' A' ' 52' ' ' ARG . 16.3 tp -132.47 113.83 13.58 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -177.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.76 124.52 35.95 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 80.9 p -142.39 -169.59 3.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.155 1.782 . . . . 0.0 106.534 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.489 ' HA ' ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 121.548 -0.72 . . . . 0.0 110.577 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.476 ' HB2' ' HD3' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' A' ' 39' ' ' LYS . . . -164.58 118.8 1.37 Allowed 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.748 0.819 . . . . 0.0 109.606 172.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -77.83 85.52 4.1 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 122.036 0.922 . . . . 0.0 109.789 177.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.403 ' HG3' HG11 ' A' ' 28' ' ' VAL . 19.7 tpp180 -137.47 90.08 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.719 -178.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -74.85 89.66 2.35 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.529 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.403 HG11 ' HG3' ' A' ' 26' ' ' ARG . 23.5 m -112.61 161.11 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.006 1.323 . . . . 0.0 109.214 172.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 58.5 t30 -69.66 160.62 31.25 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.401 0.68 . . . . 0.0 109.972 175.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.5 m -50.04 -27.56 5.74 Favored 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 124.45 1.1 . . . . 0.0 113.89 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -57.27 -34.59 68.81 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.59 0.756 . . . . 0.0 111.694 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.59 40.83 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.106 0.962 . . . . 0.0 110.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -50.56 -20.25 1.12 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -132.21 -54.2 0.97 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.301 0.64 . . . . 0.0 109.317 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.79 -144.46 45.28 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.974 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -79.85 -12.48 13.43 Favored 'Trans proline' 0 C--N 1.376 2.016 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.95 -42.9 13.65 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.572 -174.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.69 3.07 86.8 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.697 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HD3' ' HB2' ' A' ' 23' ' ' ALA . 8.4 ptpp? -160.58 109.82 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.2 m -148.57 174.92 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 123.701 0.8 . . . . 0.0 111.011 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.8 mt -98.63 108.95 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 C-N-CA 124.127 0.971 . . . . 0.0 109.306 172.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.491 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -71.72 135.39 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.142 1.377 . . . . 0.0 110.427 176.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.46 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 15.8 t70 -103.71 120.77 41.6 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 169.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -160.42 115.38 2.25 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 123.956 0.785 . . . . 0.0 110.004 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 m120 61.88 28.31 17.28 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.805 1.242 . . . . 0.0 111.838 -178.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.49 -7.69 56.78 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.564 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HB2' ' HH ' ' A' ' 49' ' ' TYR . 52.6 mt-30 -93.13 137.89 32.06 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.903 0.881 . . . . 0.0 108.646 -177.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 16.2 pt-20 -108.72 129.92 55.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.137 0.575 . . . . 0.0 109.933 -178.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.424 ' HH ' ' HB2' ' A' ' 47' ' ' GLN . 1.3 m-85 -127.07 125.54 41.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.975 0.51 . . . . 0.0 109.658 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.95 100.71 5.68 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -98.75 124.86 43.87 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -131.24 140.17 49.79 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.103 0.561 . . . . 0.0 110.261 -177.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -76.68 112.44 13.25 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 166.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 10.4 p -70.32 146.39 50.57 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -67.63 -9.46 43.29 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.435 1.094 . . . . 0.0 111.679 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.97 5.27 16.82 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.218 1.007 . . . . 0.0 111.448 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.53 40.46 15.36 Favored Glycine 0 C--N 1.353 1.492 0 C-N-CA 123.431 0.539 . . . . 0.0 112.702 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.0 mtpt -133.75 -171.4 2.71 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 122.816 0.446 . . . . 0.0 110.401 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 mt -114.88 163.91 14.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.943 0.897 . . . . 0.0 109.96 168.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.8 tp -152.18 103.05 2.83 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -90.96 102.15 14.92 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 178.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 74.4 p -118.04 153.72 33.23 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.339 0.655 . . . . 0.0 109.793 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 120.336 0.112 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.11 148.03 9.82 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.69 0.796 . . . . 0.0 110.375 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . 0.453 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 48.7 mt-10 -113.8 35.53 4.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.716 0.806 . . . . 0.0 109.702 174.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . 0.442 ' HG3' HG12 ' A' ' 28' ' ' VAL . 14.3 tpt180 -82.82 85.39 7.1 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.539 178.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . 0.453 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 6.5 mpt_? -74.28 94.67 2.53 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.135 0.493 . . . . 0.0 109.855 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . 0.442 HG12 ' HG3' ' A' ' 26' ' ' ARG . 34.6 m -107.81 172.3 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.863 1.265 . . . . 0.0 108.377 171.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.417 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 5.0 m-20 -69.15 165.35 20.59 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.94 0.496 . . . . 0.0 111.497 176.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -59.24 -32.4 69.94 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.939 0.895 . . . . 0.0 110.991 168.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -55.94 -33.88 65.14 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.059 173.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.95 35.08 3.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.125 0.97 . . . . 0.0 111.046 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -46.78 -20.18 0.12 Allowed 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.463 HD23 ' HG3' ' A' ' 53' ' ' LYS . 95.2 mt -130.89 -56.65 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.299 0.64 . . . . 0.0 109.761 172.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.83 -158.05 53.07 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.037 -177.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -76.76 -10.31 18.4 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.873 2.382 . . . . 0.0 112.274 173.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -75.0 -51.87 12.53 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.787 0.835 . . . . 0.0 109.5 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.69 0.1 88.86 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.851 -176.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -154.14 98.05 2.11 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.9 m -143.29 166.62 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 122.945 0.498 . . . . 0.0 110.929 -173.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.7 mt -98.31 117.7 43.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.136 168.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -67.79 133.47 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 125.854 1.662 . . . . 0.0 110.112 174.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . 0.417 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 19.2 t70 -104.25 113.3 26.76 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -155.15 113.8 3.54 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.397 0.436 . . . . 0.0 111.092 -175.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.67 36.98 22.54 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.414 1.486 . . . . 0.0 110.646 172.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.64 -25.01 12.07 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.442 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -91.99 156.79 17.19 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.949 0.5 . . . . 0.0 110.03 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -134.5 129.73 35.6 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.337 -174.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -134.19 133.29 40.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 122.4 -0.187 . . . . 0.0 110.508 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.61 110.98 12.88 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.491 HD13 ' HB3' ' A' ' 59' ' ' LEU . 60.9 tp -108.07 127.12 53.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 170.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.94 144.73 51.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.093 0.473 . . . . 0.0 110.342 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.463 ' HG3' HD23 ' A' ' 34' ' ' LEU . 60.3 mtpt -83.75 98.53 9.74 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 169.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.6 p -63.78 139.64 58.79 Favored 'General case' 0 C--O 1.246 0.901 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -64.92 -12.66 51.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.431 1.082 . . . . 0.0 112.331 -176.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.64 -13.36 62.3 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.52 0.728 . . . . 0.0 111.569 171.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.02 37.74 4.56 Favored Glycine 0 C--N 1.349 1.288 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.153 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -132.36 165.25 24.65 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.669 0.388 . . . . 0.0 110.402 -175.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.491 ' HB3' HD13 ' A' ' 51' ' ' LEU . 76.1 mt -100.97 142.3 32.64 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.725 0.81 . . . . 0.0 109.158 167.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.4 tp -130.97 104.18 6.97 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -93.29 101.59 13.84 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.5 p -115.91 152.44 33.44 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.563 1.145 . . . . 0.0 109.355 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.422 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.785 0.834 . . . . 0.0 108.802 -177.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.58 128.91 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.107 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -86.24 79.46 9.07 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.739 0.816 . . . . 0.0 109.94 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -142.42 96.15 2.9 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.93 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.7 mtm105 -85.32 96.95 9.69 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.212 0.53 . . . . 0.0 109.937 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -112.8 168.6 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.375 1.07 . . . . 0.0 108.899 171.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -57.26 159.51 4.52 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.512 0.725 . . . . 0.0 111.758 177.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.9 p -56.85 -27.39 60.26 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.901 0.88 . . . . 0.0 111.544 168.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.94 -37.3 76.4 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.863 0.865 . . . . 0.0 110.884 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -106.26 37.09 2.37 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.666 0.786 . . . . 0.0 110.869 174.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.51 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -49.55 -20.29 0.73 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' LEU . . . . . 0.532 HD11 ' HD2' ' A' ' 53' ' ' LYS . 94.6 mt -126.22 -42.6 1.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.13 0.572 . . . . 0.0 110.299 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.66 -158.9 43.18 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.993 -176.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -79.07 -4.99 14.27 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.641 2.227 . . . . 0.0 112.189 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.89 -33.52 19.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.582 1.153 . . . . 0.0 110.876 -178.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.65 -4.32 60.83 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.81 -173.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.24 105.07 2.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.692 0.797 . . . . 0.0 110.357 -175.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.9 m -148.55 171.54 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.663 0.785 . . . . 0.0 110.05 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.0 mt -89.5 119.35 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 123.247 0.619 . . . . 0.0 109.799 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.69 137.62 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.498 1.519 . . . . 0.0 109.263 172.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -126.01 122.39 35.74 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 170.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -158.0 110.56 2.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.783 0.433 . . . . 0.0 111.101 -177.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.37 30.94 20.71 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 125.015 1.326 . . . . 0.0 111.6 173.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -18.98 56.49 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.675 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -91.25 128.6 37.13 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.8 135.47 52.97 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.476 0.71 . . . . 0.0 109.97 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -139.01 164.43 29.78 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -103.63 126.62 50.89 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 59' ' ' LEU . 37.3 tp -120.36 122.1 40.05 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 170.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -122.12 138.6 54.4 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.638 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LYS . . . . . 0.563 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.0 mtpm? -82.72 117.3 22.55 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 171.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.49 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 23.6 p -74.87 147.65 40.88 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -67.14 -12.99 61.51 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.6 -6.54 31.83 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.884 0.874 . . . . 0.0 111.859 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.23 37.94 7.47 Favored Glycine 0 C--N 1.355 1.613 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' LYS . . . . . 0.49 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 54.8 mtpt -136.54 -169.5 2.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.418 0.687 . . . . 0.0 110.405 -171.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LEU . . . . . 0.5 ' HB3' HD13 ' A' ' 51' ' ' LEU . 78.6 mt -118.33 166.38 12.7 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.753 1.221 . . . . 0.0 109.979 176.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.5 tp -153.43 103.75 2.69 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -93.99 101.76 13.82 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -177.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.6 p -118.03 133.31 56.03 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.208 1.003 . . . . 0.0 109.861 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.459 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.4 mpt? . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -82.58 162.37 21.97 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.505 0.722 . . . . 0.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -79.12 136.56 37.17 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.171 0.589 . . . . 0.0 110.108 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -94.32 139.67 30.78 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 165.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -65.79 110.26 2.76 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.571 0.748 . . . . 0.0 112.318 -168.803 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -82.82 162.49 21.63 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.151 0.98 . . . . 0.0 109.842 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 78.9 m 73.24 114.77 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.314 1.446 . . . . 0.0 109.897 -169.759 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -141.16 -171.74 3.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.717 0.807 . . . . 0.0 110.485 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.3 mp -71.18 138.48 84.52 Favored Pre-proline 0 CA--C 1.55 0.952 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.153 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.07 168.45 21.92 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 123.034 2.489 . . . . 0.0 112.919 -176.31 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -70.23 158.58 87.18 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.479 0.712 . . . . 0.0 110.916 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_exo -48.17 135.16 24.88 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.691 2.927 . . . . 0.0 114.753 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -94.66 159.98 14.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.189 0.996 . . . . 0.0 110.194 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -69.86 95.38 0.91 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.348 0.659 . . . . 0.0 109.491 172.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.8 mt -117.16 23.08 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.629 0 CA-C-O 122.806 1.289 . . . . 0.0 108.892 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -142.98 139.73 30.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.31 1.044 . . . . 0.0 108.796 177.145 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -140.87 31.78 1.8 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.299 0.639 . . . . 0.0 111.467 -172.502 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.41 111.83 7.94 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -84.92 140.8 30.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.531 0.733 . . . . 0.0 110.521 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.2 mt -68.5 150.1 48.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.4 0.437 . . . . 0.0 110.053 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 92.3 mt -86.97 151.93 52.71 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.468 -176.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -54.19 152.14 26.03 Favored 'Trans proline' 0 C--N 1.386 2.5 0 C-N-CA 123.06 2.507 . . . . 0.0 113.563 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.73 -33.11 71.22 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.196 0.599 . . . . 0.0 110.952 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.98 155.4 20.94 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 124.299 0.999 . . . . 0.0 109.243 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -108.49 23.32 14.7 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.511 ' HG3' HG13 ' A' ' 28' ' ' VAL . 17.6 tpp180 -88.55 95.98 10.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.375 0.67 . . . . 0.0 110.721 -176.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.57 90.22 4.52 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.863 0.465 . . . . 0.0 110.038 174.605 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.511 HG13 ' HG3' ' A' ' 26' ' ' ARG . 16.4 m -103.28 152.78 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.628 0.771 . . . . 0.0 109.438 170.065 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -62.02 157.13 19.49 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.583 0.753 . . . . 0.0 111.73 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 31.5 t -44.44 -40.59 5.62 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.962 1.705 . . . . 0.0 115.278 -174.73 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -64.22 -27.68 69.22 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 118.356 0.525 . . . . 0.0 111.44 -175.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.78 30.86 3.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.338 1.055 . . . . 0.0 111.007 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -48.3 -27.7 2.68 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.088 1.355 . . . . 0.0 114.439 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.6 mt -132.03 -53.27 0.98 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 -146.55 50.42 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.848 -172.519 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.31 -2.85 8.62 Favored 'Trans proline' 0 C--N 1.371 1.726 0 C-N-CA 122.582 2.188 . . . . 0.0 112.376 168.757 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -80.74 -60.1 2.43 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 123.822 0.849 . . . . 0.0 110.394 -176.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.28 -28.85 12.25 Favored Glycine 0 C--N 1.349 1.259 0 CA-C-O 119.662 -0.521 . . . . 0.0 114.37 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.487 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -134.43 95.42 3.38 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.109 0.954 . . . . 0.0 111.387 -177.304 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -143.11 161.36 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.396 0.678 . . . . 0.0 110.037 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.561 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 34.4 mt -89.72 124.83 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 C-N-CA 123.183 0.593 . . . . 0.0 109.62 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.524 HG21 ' HA ' ' A' ' 30' ' ' SER . 1.3 mp -81.86 119.45 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 C-N-CA 125.135 1.374 . . . . 0.0 109.438 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -96.24 109.44 21.92 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 175.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 49.6 t-80 -165.35 148.28 8.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.9 0.88 . . . . 0.0 109.872 -174.135 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.8 t30 69.04 23.48 6.54 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.396 1.079 . . . . 0.0 111.142 171.319 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.48 24.32 76.19 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.909 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -138.6 177.98 7.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.855 1.262 . . . . 0.0 109.494 -175.767 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -134.32 149.34 50.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.765 0.826 . . . . 0.0 108.866 169.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.656 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 3.6 p90 -158.84 125.59 4.71 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.493 0.717 . . . . 0.0 111.159 176.639 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -75.24 115.83 15.31 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.184 0.994 . . . . 0.0 109.843 -172.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.502 HD11 ' HB3' ' A' ' 59' ' ' LEU . 55.7 tp -109.97 124.39 51.34 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.487 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 8.0 ptm180 -129.93 152.21 49.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.027 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.549 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.0 mtpm? -90.56 108.31 19.72 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 168.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 p -72.57 136.63 45.85 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -60.25 -27.23 67.06 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.177 0.991 . . . . 0.0 112.218 -174.095 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.46 -22.79 55.85 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.186 0.994 . . . . 0.0 112.039 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.51 41.31 0.96 Allowed Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.626 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -137.01 172.68 12.65 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.318 0.58 . . . . 0.0 111.79 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.502 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.8 mt -106.84 148.26 28.74 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.158 169.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.9 tp -137.92 99.59 3.94 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -89.69 122.47 32.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 177.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.6 p -135.16 131.66 37.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.615 0.766 . . . . 0.0 109.766 -174.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HD2' ' HB3' ' A' ' 49' ' ' TYR . 30.3 mmmt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.261 1.024 . . . . 0.0 108.701 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.437 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 110.644 -0.132 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.4 m -69.25 86.09 0.4 Allowed 'General case' 0 C--N 1.357 0.935 0 C-N-CA 123.72 0.808 . . . . 0.0 111.611 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.9 mtm180 -133.52 -41.44 0.87 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.095 1.358 . . . . 0.0 108.526 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.8 tpt 65.32 -101.43 0.08 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.933 1.693 . . . . 0.0 109.462 -171.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 172.86 75.44 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.852 1.261 . . . . 0.0 107.784 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 66.57 132.54 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 125.199 1.399 . . . . 0.0 111.844 -175.214 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.0 m -137.11 113.73 10.26 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.924 -0.485 . . . . 0.0 109.978 175.937 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -156.94 163.3 39.29 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.997 0.919 . . . . 0.0 109.975 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.2 mt -114.47 152.01 45.72 Favored Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 123.362 0.665 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -65.75 147.63 85.89 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 122.755 2.303 . . . . 0.0 111.779 175.381 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -83.59 139.64 41.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.158 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -46.92 131.33 16.71 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 124.084 3.189 . . . . 0.0 114.449 177.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -89.39 125.69 35.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.529 1.132 . . . . 0.0 109.337 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.99 144.03 26.44 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.0 mt -105.55 76.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.4 t70 63.56 170.78 0.16 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 124.719 1.208 . . . . 0.0 112.973 170.938 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -155.23 144.5 21.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.274 1.029 . . . . 0.0 109.236 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -130.8 -49.91 1.04 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.404 0.682 . . . . 0.0 110.071 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.6 t -69.25 143.7 53.84 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.68 0.792 . . . . 0.0 112.585 -172.051 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.5 mt -81.06 163.75 22.97 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.875 0.87 . . . . 0.0 109.428 168.749 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.7 138.68 24.96 Favored Pre-proline 0 N--CA 1.475 0.806 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.019 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -59.17 139.41 90.24 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.667 2.245 . . . . 0.0 111.776 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.462 ' HB2' ' HB2' ' A' ' 39' ' ' LYS . . . -55.87 -34.69 65.72 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.887 0.875 . . . . 0.0 111.488 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.39 159.04 19.22 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.798 1.239 . . . . 0.0 108.95 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.436 ' HA ' HD13 ' A' ' 41' ' ' ILE . 0.1 OUTLIER -114.12 22.49 13.79 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.311 0.577 . . . . 0.0 109.865 171.408 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.403 ' HG3' HG11 ' A' ' 28' ' ' VAL . 10.2 tpp180 -85.47 103.22 14.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.11 178.343 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -79.75 107.82 12.82 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.403 HG11 ' HG3' ' A' ' 26' ' ' ARG . 22.5 m -122.56 153.17 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 169.008 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -62.75 164.75 7.4 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.968 0.507 . . . . 0.0 111.932 -174.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.2 m -55.35 -33.76 63.66 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.934 0.894 . . . . 0.0 112.916 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.87 -32.47 69.51 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.155 0.982 . . . . 0.0 111.776 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -105.04 31.25 4.96 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.576 1.15 . . . . 0.0 111.443 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.448 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.5 pt? -45.51 -24.64 0.34 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -174.563 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.537 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 82.4 mt -123.05 -58.52 1.64 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.658 0.663 . . . . 0.0 111.227 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.71 -155.36 46.57 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 123.849 0.718 . . . . 0.0 112.906 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -73.64 -16.03 24.11 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 123.023 2.482 . . . . 0.0 112.001 172.365 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -79.63 -54.51 5.81 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.27 1.028 . . . . 0.0 110.73 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.537 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 82.47 3.48 90.51 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.482 -171.5 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.462 ' HB2' ' HB2' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -147.96 89.58 1.75 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.203 1.001 . . . . 0.0 110.009 -177.26 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 m -145.35 170.8 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.787 0.835 . . . . 0.0 110.537 -176.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.436 HD13 ' HA ' ' A' ' 25' ' ' GLU . 26.0 mt -94.33 112.31 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 123.409 0.683 . . . . 0.0 109.913 179.899 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.459 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -70.8 115.89 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.754 1.621 . . . . 0.0 110.476 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.44 104.05 16.22 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 171.345 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -102.63 86.53 2.79 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 168.06 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.0 m120 55.08 55.46 7.63 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.175 1.39 . . . . 0.0 111.329 176.602 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.9 -26.33 13.25 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.682 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.37 106.05 13.93 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.459 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 10.2 pt-20 -101.8 124.48 47.52 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.211 0.604 . . . . 0.0 111.443 -171.507 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.641 ' HB3' ' HB3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.32 135.34 38.82 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.914 0.886 . . . . 0.0 109.633 178.192 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -78.26 129.55 35.2 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.585 HD11 ' HB3' ' A' ' 59' ' ' LEU . 61.0 tp -122.98 136.63 54.93 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.606 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -141.09 142.63 34.11 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.365 0.416 . . . . 0.0 111.796 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -78.69 102.83 8.25 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.348 0.659 . . . . 0.0 109.497 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -73.47 133.75 43.74 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -70.47 -8.25 49.63 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 124.011 0.82 . . . . 0.0 110.702 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.92 -18.29 59.77 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.562 1.145 . . . . 0.0 111.718 167.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.51 34.35 3.89 Favored Glycine 0 C--N 1.344 0.973 0 C-N-CA 123.414 0.53 . . . . 0.0 112.74 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -144.08 175.22 10.21 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.334 0.588 . . . . 0.0 111.47 -175.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.585 ' HB3' HD11 ' A' ' 51' ' ' LEU . 30.8 mt -106.86 146.97 30.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.751 1.221 . . . . 0.0 108.858 165.537 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -132.86 102.23 5.56 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.407 0.683 . . . . 0.0 109.203 -175.883 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -88.94 103.23 15.84 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 43.8 p -109.03 135.02 50.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.674 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.641 ' HB3' ' HB3' ' A' ' 49' ' ' TYR . 22.6 pttm . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 123.65 0.78 . . . . 0.0 110.326 -176.046 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.9 mtp . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m 60.02 88.62 0.07 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.9 1.28 . . . . 0.0 112.707 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -116.4 84.17 2.08 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.8 ttt -120.19 125.69 48.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.704 0.801 . . . . 0.0 109.104 173.819 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -149.06 142.87 25.64 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -145.54 46.98 1.29 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.224 0.61 . . . . 0.0 110.501 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 15.5 p -62.57 86.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.232 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -130.53 168.91 16.29 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.727 1.211 . . . . 0.0 108.718 177.252 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.92 126.39 92.57 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 123.514 0.726 . . . . 0.0 109.824 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -68.3 63.0 1.09 Allowed 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.824 3.016 . . . . 0.0 112.924 170.418 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -146.13 136.31 12.01 Favored Pre-proline 0 C--O 1.243 0.748 0 C-N-CA 125.79 1.636 . . . . 0.0 106.969 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.9 165.8 26.75 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 122.124 1.883 . . . . 0.0 111.239 174.209 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -78.92 81.01 5.24 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -69.48 116.3 9.73 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.465 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 79.3 mt -74.23 91.64 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.808 0.813 . . . . 0.0 109.174 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -128.74 93.83 3.71 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.211 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -96.01 119.01 33.74 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.326 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -124.22 39.28 4.01 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.411 0.684 . . . . 0.0 110.235 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.4 t -68.3 155.22 40.21 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.096 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.8 mt -72.12 156.96 38.61 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.159 0.584 . . . . 0.0 111.421 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.7 mt -83.15 152.51 65.2 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 -174.59 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.24 158.88 52.62 Favored 'Trans proline' 0 C--N 1.384 2.442 0 C-N-CA 122.919 2.412 . . . . 0.0 111.808 174.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.65 -60.61 2.29 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.54 149.55 9.87 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.161 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.476 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 35.0 mt-10 -100.45 28.53 4.97 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.962 0.905 . . . . 0.0 111.325 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -81.06 92.52 6.24 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.486 0.714 . . . . 0.0 111.099 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.476 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 11.1 mpt_? -74.48 106.77 6.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 174.193 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 m -140.5 145.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.782 1.233 . . . . 0.0 109.374 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 59.8 t30 -60.95 159.95 10.58 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 -178.716 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.2 m -43.03 -30.43 0.43 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 174.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -55.49 -42.64 74.69 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.488 0.661 . . . . 0.0 111.175 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.94 37.54 1.94 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.557 1.143 . . . . 0.0 110.841 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.587 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -54.33 -22.46 12.18 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.534 HD13 ' HD2' ' A' ' 53' ' ' LYS . 96.0 mt -134.65 -52.53 0.81 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.253 0.549 . . . . 0.0 109.554 174.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.67 -152.26 50.33 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.024 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.35 3.8 6.7 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.83 2.353 . . . . 0.0 112.837 170.03 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.13 -58.16 2.56 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.595 0.758 . . . . 0.0 109.873 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.55 -22.91 29.55 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.364 -0.686 . . . . 0.0 113.779 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -133.67 101.27 5.05 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-N 118.493 1.147 . . . . 0.0 111.276 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.4 m -142.07 167.83 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 121.816 -0.552 . . . . 0.0 111.335 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.416 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 59.8 mt -92.68 111.62 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.47 1.108 . . . . 0.0 108.868 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.587 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -80.77 111.24 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.162 0.985 . . . . 0.0 109.663 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 19.3 t70 -89.11 122.13 32.12 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.885 1.274 . . . . 0.0 107.935 174.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -171.48 143.55 1.8 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.276 0.63 . . . . 0.0 110.723 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.0 t30 62.92 21.34 12.81 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 124.696 1.198 . . . . 0.0 112.18 170.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.06 -4.49 78.01 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 121.872 -0.517 . . . . 0.0 113.527 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -120.26 171.7 8.31 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.718 0.771 . . . . 0.0 111.512 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.416 ' HB2' ' CG2' ' A' ' 41' ' ' ILE . 1.0 OUTLIER -129.82 137.73 50.62 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.294 179.556 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.503 ' HD1' ' HE3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -137.18 118.1 14.23 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.513 0.725 . . . . 0.0 109.087 -178.723 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -76.5 103.41 6.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.426 0.69 . . . . 0.0 109.235 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.461 HD13 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -104.68 118.74 37.33 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -123.85 134.51 53.57 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 123.764 0.665 . . . . 0.0 109.859 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.624 ' HZ2' ' HB3' ' A' ' 53' ' ' LYS . 9.6 mtpm? -79.31 99.25 7.02 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 173.187 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -62.69 136.62 57.97 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 176.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -70.42 -4.83 24.42 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.636 0.774 . . . . 0.0 111.704 -177.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.35 -11.84 60.17 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.57 1.148 . . . . 0.0 112.071 166.06 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.58 40.07 5.13 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 123.539 0.59 . . . . 0.0 112.289 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -140.89 170.84 14.99 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.87 0.468 . . . . 0.0 110.726 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.461 ' HB3' HD13 ' A' ' 51' ' ' LEU . 72.1 mt -106.78 139.73 40.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.479 1.112 . . . . 0.0 109.498 172.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -127.12 100.95 6.32 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.82 113.79 25.41 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.5 p -130.31 -179.12 5.07 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.972 1.309 . . . . 0.0 108.17 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.503 ' HE3' ' HD1' ' A' ' 49' ' ' TYR . 46.1 mmtm . . . . . 0 C--O 1.251 1.168 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 p -150.22 133.22 16.13 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.278 0.631 . . . . 0.0 109.898 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -80.19 146.97 31.48 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.275 0.63 . . . . 0.0 111.191 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' A' ' 4' ' ' MET . 1.5 mpt? -100.44 72.8 1.61 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 171.573 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -80.01 -7.29 58.76 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.377 -173.906 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -55.77 127.63 31.03 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.946 0.898 . . . . 0.0 111.531 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.6 t -160.69 125.26 3.66 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.777 0.831 . . . . 0.0 109.656 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -124.49 90.57 3.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.769 0.827 . . . . 0.0 109.798 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -74.04 161.51 78.14 Favored Pre-proline 0 CA--C 1.556 1.201 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.273 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -40.77 139.22 1.35 Allowed 'Trans proline' 0 C--N 1.393 2.876 0 C-N-CA 123.905 3.07 . . . . 0.0 114.267 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -162.17 166.06 14.77 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.263 1.025 . . . . 0.0 110.174 -166.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -51.09 141.54 37.66 Favored 'Trans proline' 0 C--N 1.387 2.553 0 C-N-CA 123.151 2.568 . . . . 0.0 114.384 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -73.84 135.6 43.43 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.531 0.732 . . . . 0.0 110.995 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -66.46 114.37 5.4 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.213 1.005 . . . . 0.0 111.361 -173.279 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.3 mt -98.71 94.83 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.484 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -95.62 148.58 22.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.268 0.627 . . . . 0.0 109.996 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -74.62 87.27 2.15 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.062 0.458 . . . . 0.0 109.967 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -7.36 59.55 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.741 0.816 . . . . 0.0 110.854 177.097 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.3 m -52.08 128.6 25.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.181 1.392 . . . . 0.0 112.505 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.0 mt -73.68 158.6 34.39 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.693 0.797 . . . . 0.0 110.878 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mp -88.63 149.26 43.73 Favored Pre-proline 0 CA--C 1.546 0.799 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.617 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.28 150.38 88.41 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 122.816 2.344 . . . . 0.0 111.565 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.11 -54.14 45.49 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.727 0.411 . . . . 0.0 110.377 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.63 149.23 26.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.841 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.43 24.13 13.17 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.721 0.808 . . . . 0.0 109.366 171.104 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -83.31 90.24 7.11 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.177 0.991 . . . . 0.0 110.123 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -77.58 96.49 4.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.2 m -119.99 156.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.431 1.092 . . . . 0.0 109.198 171.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -59.27 155.74 13.83 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.941 0.896 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.414 ' HA ' HG21 ' A' ' 42' ' ' ILE . 22.8 t -51.93 -26.81 11.15 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.584 -178.823 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.6 -35.83 73.05 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.445 0.698 . . . . 0.0 111.701 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.71 40.63 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.946 0.898 . . . . 0.0 109.908 177.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -47.17 -16.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 177.188 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.518 HD12 ' HD2' ' A' ' 53' ' ' LYS . 97.1 mt -119.17 -32.18 4.48 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 121.728 -0.608 . . . . 0.0 110.636 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.25 -166.26 37.89 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.958 -177.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.21 -10.32 19.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 122.631 2.22 . . . . 0.0 112.097 173.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -91.65 -24.12 19.63 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.785 0.834 . . . . 0.0 110.625 -175.496 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.46 -6.29 73.6 Favored Glycine 0 C--N 1.35 1.357 0 O-C-N 123.165 0.291 . . . . 0.0 112.592 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.63 110.2 3.8 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.136 0.974 . . . . 0.0 108.956 -177.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.2 m -146.75 171.89 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.448 0.699 . . . . 0.0 110.742 -176.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.6 mt -92.54 116.12 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.457 171.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.457 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.46 136.11 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 125.21 1.404 . . . . 0.0 109.505 174.064 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -115.03 118.34 33.13 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 124.406 1.082 . . . . 0.0 108.404 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -152.45 113.81 4.27 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.458 0.473 . . . . 0.0 111.065 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 t30 63.54 28.9 15.34 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.821 1.248 . . . . 0.0 111.044 171.779 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.51 2.55 87.15 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.452 -0.794 . . . . 0.0 114.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.479 ' HB2' ' HH ' ' A' ' 49' ' ' TYR . 81.4 mm-40 -111.02 128.57 55.9 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.838 0.855 . . . . 0.0 109.086 179.3 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.457 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 15.4 pt-20 -113.02 137.82 50.82 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.284 0.634 . . . . 0.0 110.957 -175.367 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.479 ' HH ' ' HB2' ' A' ' 47' ' ' GLN . 0.2 OUTLIER -135.31 149.53 49.78 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.348 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -100.35 109.51 21.69 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.854 0.752 . . . . 0.0 109.071 177.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.487 HD12 ' HB3' ' A' ' 59' ' ' LEU . 51.0 tp -107.34 125.85 51.72 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.09 135.66 48.48 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 123.915 0.76 . . . . 0.0 110.54 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HD2' HD12 ' A' ' 34' ' ' LEU . 62.0 mtpt -77.01 108.01 9.77 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.744 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -72.29 139.53 48.07 Favored 'General case' 0 C--O 1.249 1.039 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -74.07 -4.72 37.24 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.7 0.625 . . . . 0.0 111.015 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.8 -23.85 67.37 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 110.789 165.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.1 36.99 2.05 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.349 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -134.12 177.66 7.57 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.313 0.578 . . . . 0.0 111.413 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.487 ' HB3' HD12 ' A' ' 51' ' ' LEU . 89.6 mt -114.07 138.86 49.84 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.135 1.374 . . . . 0.0 108.35 169.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -133.28 102.27 5.49 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -174.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -86.06 121.8 29.18 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.9 p -130.49 158.62 39.44 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.996 0.918 . . . . 0.0 109.643 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 124.157 0.983 . . . . 0.0 109.01 -177.777 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtt . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 m -74.54 90.17 2.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.142 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -166.75 137.01 3.15 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 124.06 0.944 . . . . 0.0 110.293 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.472 ' HG3' ' HG2' ' A' ' 8' ' ' GLU . 15.2 ptp -159.66 92.0 1.02 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.5 t70 55.14 57.31 5.64 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.393 1.077 . . . . 0.0 108.631 -166.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 38.7 t30 61.46 -80.71 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 114.062 -1.426 . . . . 0.0 108.833 -163.02 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.0 m -150.4 103.38 3.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.138 0.975 . . . . 0.0 108.529 171.491 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.472 ' HG2' ' HG3' ' A' ' 4' ' ' MET . 10.2 pt-20 -75.12 111.06 9.96 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 173.19 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.35 79.55 48.54 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 123.347 0.659 . . . . 0.0 112.151 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.83 -174.52 2.27 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 122.718 2.278 . . . . 0.0 111.267 169.298 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -81.82 118.26 71.44 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.925 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -65.84 99.76 0.4 Allowed 'Trans proline' 0 C--N 1.379 2.18 0 C-N-CA 122.944 2.43 . . . . 0.0 112.649 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -67.43 -67.31 0.47 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 171.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -178.62 110.48 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.997 1.319 . . . . 0.0 108.511 173.106 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.5 mt -95.52 69.21 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -168.6 161.57 11.52 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.635 -178.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -144.37 97.51 3.05 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.115 0.566 . . . . 0.0 110.353 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -143.73 114.37 7.61 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 163.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.0 m -80.22 85.98 5.68 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.694 0.759 . . . . 0.0 110.66 -171.71 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.35 167.85 15.19 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.81 -1.087 . . . . 0.0 109.947 176.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 69.21 139.94 0.07 OUTLIER Pre-proline 0 N--CA 1.493 1.675 0 C-N-CA 124.305 1.042 . . . . 0.0 112.084 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.55 132.94 32.63 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 122.082 1.855 . . . . 0.0 110.129 168.144 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.59 -37.81 58.85 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.744 0.818 . . . . 0.0 112.496 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.58 -172.72 2.51 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 124.446 1.092 . . . . 0.0 110.398 175.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.25 27.17 8.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.323 1.049 . . . . 0.0 109.95 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.4 ' HG3' HG11 ' A' ' 28' ' ' VAL . 18.7 tpp180 -72.63 76.64 1.09 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.255 1.022 . . . . 0.0 109.524 179.189 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.437 ' HA ' ' HB ' ' A' ' 41' ' ' ILE . 2.7 ttm180 -82.91 86.23 6.99 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -171.966 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.4 HG11 ' HG3' ' A' ' 26' ' ' ARG . 35.5 m -113.67 154.0 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.227 1.011 . . . . 0.0 109.763 -175.731 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.39 152.08 11.97 Favored 'General case' 0 CA--C 1.555 1.168 0 O-C-N 123.716 0.635 . . . . 0.0 111.042 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -50.04 -24.98 2.98 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -58.22 -33.4 69.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.729 0.412 . . . . 0.0 111.587 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.48 35.3 3.12 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.456 1.102 . . . . 0.0 110.401 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.401 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.7 pt? -53.62 -19.01 3.4 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.174 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.45 HD23 ' HG3' ' A' ' 53' ' ' LYS . 96.0 mt -133.11 -65.91 0.68 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 168.765 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.0 -155.29 53.15 Favored Glycine 0 CA--C 1.533 1.188 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.465 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -80.8 2.8 8.28 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 123.035 2.49 . . . . 0.0 112.828 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -97.79 -59.0 1.86 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.342 1.057 . . . . 0.0 109.465 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.27 -11.16 65.5 Favored Glycine 0 C--N 1.347 1.143 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -141.54 78.74 1.65 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 122.866 1.317 . . . . 0.0 110.868 -175.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.98 159.94 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.773 -168.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.437 ' HB ' ' HA ' ' A' ' 27' ' ' ARG . 50.7 mt -90.15 110.58 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.766 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.491 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.35 105.15 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.634 1.174 . . . . 0.0 109.997 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.3 121.7 24.77 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 166.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -145.83 100.3 3.39 Favored 'General case' 0 C--O 1.239 0.537 0 O-C-N 124.038 0.836 . . . . 0.0 109.101 -177.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 61.61 23.24 13.58 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.152 1.381 . . . . 0.0 111.641 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.79 -22.35 40.0 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.653 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -80.92 111.56 17.5 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.5 pt-20 -104.46 131.27 52.03 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.524 0.729 . . . . 0.0 110.222 -175.88 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.495 ' HD2' HD21 ' A' ' 61' ' ' LEU . 5.6 p90 -148.52 123.86 10.27 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.124 0.57 . . . . 0.0 111.883 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.439 ' HB3' ' HG1' ' A' ' 62' ' ' THR . 3.4 tm? -74.12 110.84 8.74 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.033 1.333 . . . . 0.0 110.061 -175.55 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.559 HD13 ' HB3' ' A' ' 59' ' ' LEU . 53.7 tp -104.37 129.41 52.29 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -131.93 133.86 45.01 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.546 0.529 . . . . 0.0 111.255 -174.47 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.45 ' HG3' HD23 ' A' ' 34' ' ' LEU . 60.5 mtpt -85.11 105.0 15.51 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.953 0.901 . . . . 0.0 109.491 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.1 p -71.92 145.27 48.59 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -63.3 -20.49 65.53 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 124.708 1.255 . . . . 0.0 112.323 -175.469 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.407 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . . . -64.77 -15.72 62.03 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.819 0.848 . . . . 0.0 111.767 172.786 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.93 37.94 4.78 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 124.27 0.938 . . . . 0.0 111.95 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.407 ' HE2' ' HB3' ' A' ' 56' ' ' ALA . 43.9 mtmt -127.64 161.44 28.86 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 120.809 0.337 . . . . 0.0 111.417 -173.612 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.559 ' HB3' HD13 ' A' ' 51' ' ' LEU . 48.3 mt -110.34 126.81 54.63 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.187 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -115.93 114.69 25.0 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.747 1.219 . . . . 0.0 108.82 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.54 HD22 HD11 ' A' ' 51' ' ' LEU . 1.8 tm? -102.36 100.4 10.55 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.439 ' HG1' ' HB3' ' A' ' 50' ' ' LEU . 44.5 p -105.73 152.82 22.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.515 1.126 . . . . 0.0 108.922 171.755 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 123.13 0.572 . . . . 0.0 109.985 177.857 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.422 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 m -69.46 84.44 0.41 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.476 0.71 . . . . 0.0 109.756 174.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -83.94 77.13 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.342 0.657 . . . . 0.0 110.773 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.58 102.06 14.49 Favored 'General case' 0 C--N 1.348 0.513 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.453 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -148.54 119.15 7.46 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -155.84 146.07 21.63 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.183 0.993 . . . . 0.0 108.957 -177.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -155.63 153.48 30.12 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.384 0.674 . . . . 0.0 109.48 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.81 104.62 11.45 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 171.86 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.6 mt -61.58 111.04 3.72 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 124.702 1.201 . . . . 0.0 111.627 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -93.19 -175.28 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 123.09 2.527 . . . . 0.0 112.336 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -158.0 58.37 1.4 Allowed Pre-proline 0 CA--C 1.554 1.127 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.978 172.859 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -65.53 143.98 77.49 Favored 'Trans proline' 0 C--N 1.38 2.189 0 C-N-CA 122.038 1.825 . . . . 0.0 111.115 -179.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -73.33 82.36 1.39 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.199 0.523 . . . . 0.0 109.879 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.17 98.1 7.18 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.636 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.2 mt -76.08 78.37 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 121.663 0.744 . . . . 0.0 109.73 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -93.69 -57.08 2.67 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -169.43 22.87 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.07 0 O-C-N 124.339 1.024 . . . . 0.0 110.07 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -64.74 116.22 6.06 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-O 121.714 0.769 . . . . 0.0 111.369 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.2 m -146.82 143.55 28.68 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.158 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.76 169.38 16.83 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-O 121.179 0.514 . . . . 0.0 110.806 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -70.2 163.58 60.65 Favored Pre-proline 0 CA--C 1.557 1.233 0 C-N-CA 123.811 0.844 . . . . 0.0 110.484 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -48.06 142.49 15.68 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.477 2.118 . . . . 0.0 112.353 169.289 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.34 -35.24 50.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.522 0.729 . . . . 0.0 111.797 -177.195 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -147.43 148.66 31.51 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 166.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -96.61 35.1 1.55 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.4 0.68 . . . . 0.0 109.882 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -95.0 92.23 6.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.823 0.849 . . . . 0.0 110.059 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -80.51 90.63 5.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 121.256 0.55 . . . . 0.0 109.798 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -117.64 157.58 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.158 0.983 . . . . 0.0 109.407 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -48.41 154.65 0.6 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 125.263 1.425 . . . . 0.0 112.813 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.6 m -54.59 -30.6 54.99 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.767 0.827 . . . . 0.0 111.568 170.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -53.52 -41.15 66.07 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.898 0.879 . . . . 0.0 111.683 172.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.65 36.72 2.33 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.837 0.855 . . . . 0.0 110.847 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.41 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -51.44 -21.54 2.43 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 114.671 1.359 . . . . 0.0 114.671 -179.179 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.51 HD11 ' HD2' ' A' ' 53' ' ' LYS . 98.5 mt -123.25 -42.93 2.22 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.29 -157.66 52.59 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.892 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.64 3.69 7.52 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.852 2.368 . . . . 0.0 112.315 173.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -99.76 -54.06 3.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.304 1.042 . . . . 0.0 110.239 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 108.31 -11.34 36.63 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.824 -0.625 . . . . 0.0 114.459 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 pptp? -146.69 111.7 5.38 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 117.887 0.844 . . . . 0.0 110.772 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.8 m -147.06 167.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 124.219 1.008 . . . . 0.0 109.908 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.484 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 58.9 mt -90.75 120.85 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 172.544 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.416 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -79.77 110.17 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 124.897 1.279 . . . . 0.0 110.376 -177.749 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.93 137.43 34.21 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.673 167.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -160.27 95.69 1.15 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.248 1.019 . . . . 0.0 109.227 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.6 m120 65.06 31.18 11.28 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.3 1.04 . . . . 0.0 111.667 172.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.5 -15.16 62.51 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.999 -0.546 . . . . 0.0 113.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -87.61 142.92 27.47 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.416 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.8 pt-20 -129.31 137.13 50.84 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.564 ' HB3' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -152.41 124.8 8.21 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.487 0.715 . . . . 0.0 110.997 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.484 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -70.82 122.9 20.75 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.524 1.13 . . . . 0.0 109.912 -175.086 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.2 tp -113.27 127.2 56.08 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 168.512 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 ptm180 -128.48 135.62 49.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.526 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.8 mtpm? -75.95 99.36 4.51 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 166.627 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -65.17 138.73 58.45 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.39 -5.7 25.25 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 123.889 0.743 . . . . 0.0 111.57 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.22 -14.63 61.11 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.065 0.946 . . . . 0.0 111.492 165.742 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 33.29 6.57 Favored Glycine 0 C--N 1.352 1.452 0 C-N-CA 124.061 0.839 . . . . 0.0 112.024 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -137.9 -175.21 4.01 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.96 0.504 . . . . 0.0 110.703 -173.534 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.473 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.1 mt -112.26 159.07 18.98 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.716 1.206 . . . . 0.0 109.774 171.829 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.7 tp -147.11 105.92 3.84 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.177 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.463 HD22 ' HB2' ' A' ' 51' ' ' LEU . 2.4 tm? -99.6 101.21 12.35 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.0 p -120.11 132.68 55.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.055 0.942 . . . . 0.0 110.031 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.564 ' HG3' ' HB3' ' A' ' 49' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.284 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 171.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.5 mtt . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -104.18 113.81 27.62 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.41 0.684 . . . . 0.0 109.807 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -75.65 117.48 17.46 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.048 0.539 . . . . 0.0 110.024 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.0 ttt -145.87 152.36 39.35 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.929 0.892 . . . . 0.0 108.901 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 67.21 102.52 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.622 1.169 . . . . 0.0 110.747 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -70.22 135.82 49.39 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.366 0.666 . . . . 0.0 110.228 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 m -75.09 147.66 40.4 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.427 0.691 . . . . 0.0 109.817 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -69.9 156.04 39.67 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.482 0.713 . . . . 0.0 111.266 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.0 mt -60.26 146.53 83.6 Favored Pre-proline 0 CA--C 1.56 1.347 0 C-N-CA 124.209 1.003 . . . . 0.0 111.639 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.77 167.83 23.31 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 122.541 2.161 . . . . 0.0 112.767 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -93.38 143.44 26.68 Favored Pre-proline 0 N--CA 1.478 0.965 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.886 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.49 146.22 84.74 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.229 2.62 . . . . 0.0 113.735 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -66.66 -31.66 72.48 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.778 0.831 . . . . 0.0 110.484 175.105 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -122.84 97.4 5.43 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.261 1.024 . . . . 0.0 108.29 175.003 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.7 mt -85.23 66.95 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 176.39 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 58.81 112.3 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 125.408 1.483 . . . . 0.0 113.06 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -142.93 126.26 16.61 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.824 0.449 . . . . 0.0 110.844 176.714 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -101.38 77.47 1.78 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 m -73.62 106.26 5.31 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.151 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -75.95 179.4 5.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.704 0.802 . . . . 0.0 112.107 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.86 141.9 90.28 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.434 1.093 . . . . 0.0 110.797 -177.305 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.6 160.12 35.06 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.749 2.3 . . . . 0.0 112.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.525 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -67.72 -54.03 22.69 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 122.847 0.459 . . . . 0.0 110.944 -177.653 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -170.67 141.87 1.92 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.804 0.69 . . . . 0.0 110.349 178.73 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -94.34 40.33 1.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.343 0.657 . . . . 0.0 110.38 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.469 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.0 tpm_? -91.15 90.69 7.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.067 0.947 . . . . 0.0 109.427 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.66 91.36 5.84 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.469 HG13 ' HG3' ' A' ' 26' ' ' ARG . 22.8 m -107.6 162.87 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.046 0.938 . . . . 0.0 109.172 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -66.13 164.03 16.4 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.859 0.463 . . . . 0.0 111.724 176.607 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.466 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 41.7 t -57.72 -28.7 64.11 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.388 1.075 . . . . 0.0 112.924 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -59.34 -32.65 70.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.052 0.541 . . . . 0.0 110.674 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.34 40.36 1.78 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.119 0.968 . . . . 0.0 110.117 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.538 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -46.54 -21.45 0.18 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.531 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -122.43 -33.0 3.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.923 0.489 . . . . 0.0 110.651 174.795 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.51 -152.56 52.36 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.296 -0.724 . . . . 0.0 112.445 -173.042 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.17 -13.69 12.44 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.667 2.245 . . . . 0.0 112.504 171.309 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -90.22 -43.0 10.7 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.882 0.873 . . . . 0.0 111.506 -170.137 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.475 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 94.58 -16.17 61.74 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.065 -171.913 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.525 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 6.5 ptpp? -130.36 93.28 3.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.736 0.814 . . . . 0.0 110.383 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.8 m -141.66 164.99 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.802 0.841 . . . . 0.0 110.515 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.0 mt -90.17 120.64 39.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.351 0.66 . . . . 0.0 109.243 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.538 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -78.76 132.01 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.032 1.333 . . . . 0.0 109.156 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.17 118.67 34.66 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 172.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.466 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 6.1 t-80 -153.43 130.28 10.92 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.726 1.21 . . . . 0.0 110.735 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.63 5.89 88.25 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.414 -0.357 . . . . 0.0 113.064 -172.454 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -94.51 154.69 17.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.827 0.851 . . . . 0.0 109.753 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.421 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -123.36 131.59 53.7 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.25 0.62 . . . . 0.0 111.008 -171.876 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -144.98 120.89 10.64 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.367 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -80.73 107.19 13.33 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.469 ' HB3' HD11 ' A' ' 42' ' ' ILE . 52.1 tp -103.09 123.62 47.0 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.107 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.459 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 7.9 ptm180 -128.92 133.47 47.88 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.293 -176.265 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -79.02 105.81 10.62 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 172.379 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -70.5 143.64 51.63 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.183 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -73.62 -3.34 27.41 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.867 0.867 . . . . 0.0 112.451 -174.208 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.83 -7.58 56.85 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.905 0.882 . . . . 0.0 110.912 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.29 37.19 5.69 Favored Glycine 0 C--N 1.35 1.32 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.595 177.175 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -129.5 166.69 19.14 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 120.987 0.422 . . . . 0.0 111.576 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.451 ' HB3' HD13 ' A' ' 51' ' ' LEU . 56.3 mt -104.7 127.24 52.4 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.137 0.975 . . . . 0.0 108.907 172.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.0 tp -121.0 103.17 8.83 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -88.3 111.84 22.15 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.491 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.4 p -122.61 137.69 54.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.435 1.094 . . . . 0.0 108.959 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt . . . . . 0 CA--C 1.554 1.099 0 C-N-CA 123.652 0.781 . . . . 0.0 109.015 -175.961 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.9 m -109.58 103.76 12.69 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 175.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 73.1 ttt-85 -128.03 -44.48 1.45 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.791 0.837 . . . . 0.0 110.29 -173.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 58.3 mtt 68.47 -165.65 0.19 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.752 1.221 . . . . 0.0 109.659 -165.437 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -142.76 78.17 1.6 Allowed 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.229 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -134.51 77.22 1.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.616 0.767 . . . . 0.0 109.854 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.6 m -99.1 154.27 18.25 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.775 171.521 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -67.96 154.67 41.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.95 0.9 . . . . 0.0 110.625 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.6 mt -61.13 119.41 45.3 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 123.553 0.741 . . . . 0.0 110.5 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.35 99.65 0.1 Allowed 'Trans proline' 0 C--N 1.382 2.319 0 C-N-CA 123.083 2.522 . . . . 0.0 112.882 -175.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -76.29 111.85 17.72 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -89.36 175.11 3.4 Favored 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 122.738 2.292 . . . . 0.0 112.621 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -130.33 113.97 15.03 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 173.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -91.31 135.4 33.84 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.585 0.754 . . . . 0.0 109.532 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 62.0 mt -120.78 124.85 73.24 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.885 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -106.38 148.68 27.8 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.548 0.739 . . . . 0.0 109.089 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -81.58 76.3 8.5 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 121.733 0.777 . . . . 0.0 109.002 176.178 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -141.0 19.79 2.29 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.673 1.189 . . . . 0.0 109.356 176.582 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.6 m -53.33 135.33 39.07 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.761 1.225 . . . . 0.0 111.656 -176.18 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.4 170.29 5.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.492 0.717 . . . . 0.0 111.836 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mp 69.64 164.89 0.13 Allowed Pre-proline 0 N--CA 1.49 1.545 0 C-N-CA 124.323 1.049 . . . . 0.0 110.622 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -54.0 140.11 69.9 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 121.809 1.673 . . . . 0.0 110.973 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.89 -28.03 67.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.023 0.529 . . . . 0.0 111.58 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.01 142.39 10.29 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.675 1.19 . . . . 0.0 108.061 167.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.468 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 11.0 pt-20 -90.59 31.89 1.01 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.313 0.577 . . . . 0.0 111.115 178.309 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -84.14 94.63 8.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.536 1.134 . . . . 0.0 109.646 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.468 ' NH1' ' HB2' ' A' ' 25' ' ' GLU . 8.8 mpt_? -76.42 105.1 7.28 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.586 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.7 m -121.86 159.66 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.163 0.985 . . . . 0.0 108.906 170.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.51 155.17 33.73 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.066 0.546 . . . . 0.0 109.661 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -55.33 -20.99 13.2 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.85 1.26 . . . . 0.0 113.714 -175.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -56.9 -38.79 73.31 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.382 0.673 . . . . 0.0 110.787 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.87 40.79 1.38 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.131 0.972 . . . . 0.0 110.511 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.425 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -50.21 -18.44 0.59 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 124.792 1.237 . . . . 0.0 114.232 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.24 -57.41 1.49 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.737 0.815 . . . . 0.0 109.488 167.92 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.27 -154.24 52.41 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.259 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -75.9 -17.56 17.54 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.435 2.09 . . . . 0.0 111.701 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.99 -41.75 73.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.28 1.032 . . . . 0.0 110.462 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.63 -5.81 49.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.795 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.41 ' HA ' ' O ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.62 105.3 2.42 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.575 1.15 . . . . 0.0 108.745 -178.214 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.8 m -144.22 169.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -173.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.439 ' HA ' ' O ' ' A' ' 49' ' ' TYR . 55.5 mt -90.07 110.87 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 114.353 -1.294 . . . . 0.0 108.63 169.471 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.513 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.8 132.28 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.208 1.403 . . . . 0.0 109.25 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -105.35 107.68 18.8 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 164.672 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -123.9 96.6 5.01 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -177.785 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 t30 60.61 42.44 13.95 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.59 1.156 . . . . 0.0 109.702 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.64 -18.7 28.48 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.82 -1.082 . . . . 0.0 114.072 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -83.96 118.55 24.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.802 0.841 . . . . 0.0 110.289 -176.096 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.513 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -88.56 133.12 34.26 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.799 0.439 . . . . 0.0 110.849 -179.669 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.439 ' O ' ' HA ' ' A' ' 41' ' ' ILE . 5.5 m-85 -131.14 177.45 7.45 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.78 108.39 9.83 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.53 HD11 ' HB3' ' A' ' 59' ' ' LEU . 47.0 tp -104.41 124.19 48.78 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.0 ptt180 -125.96 136.94 53.59 Favored 'General case' 0 C--O 1.242 0.67 0 O-C-N 123.482 0.488 . . . . 0.0 110.642 -177.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -79.15 99.12 6.83 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 168.671 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 35.8 p -68.62 149.06 49.59 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.748 178.216 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.33 -10.36 59.69 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 124.702 1.251 . . . . 0.0 113.218 -169.73 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.85 -14.34 59.91 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.472 0.709 . . . . 0.0 110.68 170.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.57 43.46 2.31 Favored Glycine 0 C--N 1.352 1.465 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.967 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -134.07 -179.49 5.59 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 116.806 0.303 . . . . 0.0 111.402 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.53 ' HB3' HD11 ' A' ' 51' ' ' LEU . 83.5 mt -124.14 129.41 50.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.844 1.258 . . . . 0.0 109.818 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -123.56 105.1 9.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.674 0.79 . . . . 0.0 109.347 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . 0.519 HD23 ' HB2' ' A' ' 51' ' ' LEU . 3.3 tm? -96.9 100.39 11.92 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.3 p -130.71 135.53 47.9 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.224 1.01 . . . . 0.0 109.617 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 123.94 0.896 . . . . 0.0 109.183 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.419 ' SD ' ' N ' ' A' ' 1' ' ' MET . 3.1 mpp? . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.2 m -72.75 147.31 45.7 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.033 0.533 . . . . 0.0 110.69 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -153.01 104.24 2.81 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 57.3 ttm -76.5 90.48 3.29 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.606 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -64.97 111.06 2.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.63 0.772 . . . . 0.0 110.502 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -84.92 160.45 20.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.302 0.641 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 87.9 m -76.8 135.43 38.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.29 0.636 . . . . 0.0 110.35 175.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -86.07 -177.88 6.4 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.456 0.702 . . . . 0.0 111.412 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.77 149.18 70.48 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 123.139 0.576 . . . . 0.0 111.551 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -62.22 174.97 2.24 Favored 'Trans proline' 0 C--N 1.382 2.333 0 C-N-CA 123.665 2.91 . . . . 0.0 113.818 173.882 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -70.88 137.42 85.17 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 123.558 0.743 . . . . 0.0 110.247 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.88 -169.21 0.64 Allowed 'Trans proline' 0 C--N 1.376 2.012 0 C-N-CA 122.698 2.265 . . . . 0.0 112.509 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -105.35 164.63 11.71 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.856 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -70.97 163.65 27.1 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.132 0.573 . . . . 0.0 110.02 168.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 60.3 mt -79.53 138.97 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -102.33 115.88 31.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.075 0.95 . . . . 0.0 109.141 178.532 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -124.57 110.01 13.91 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.222 0.609 . . . . 0.0 110.244 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -118.75 29.54 7.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.176 0.99 . . . . 0.0 110.486 -175.62 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 20.5 m -63.0 119.05 8.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.545 0.738 . . . . 0.0 111.124 -176.263 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -72.44 164.01 27.08 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.472 0.709 . . . . 0.0 110.72 178.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.0 mp -83.68 154.28 65.03 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.576 177.14 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.77 148.61 87.41 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 122.247 1.965 . . . . 0.0 111.038 168.343 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.08 69.27 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.508 0.723 . . . . 0.0 111.589 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.43 161.65 42.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.397 170.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -114.41 22.85 13.32 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.978 0.511 . . . . 0.0 109.987 171.155 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -77.18 88.61 3.64 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -77.14 87.85 3.61 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 121.803 0.811 . . . . 0.0 110.11 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -116.8 159.32 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 114.46 -1.246 . . . . 0.0 109.347 178.331 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -59.37 161.43 5.65 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.913 0.885 . . . . 0.0 112.248 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.422 ' HA ' HG21 ' A' ' 42' ' ' ILE . 54.9 p -54.41 -30.33 51.92 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.068 0.947 . . . . 0.0 113.377 177.926 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -62.65 -30.79 71.63 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.643 0.377 . . . . 0.0 111.728 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.06 34.72 2.93 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.069 0.948 . . . . 0.0 110.661 176.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.467 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -49.48 -17.91 0.35 Allowed 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.526 HD12 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -125.58 -41.92 1.98 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.118 0.567 . . . . 0.0 110.089 174.133 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.67 -162.89 44.4 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.174 0.921 . . . . 0.0 112.699 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.5 -15.34 34.32 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.549 2.166 . . . . 0.0 112.274 172.445 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.92 -40.66 46.41 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.06 0.944 . . . . 0.0 111.165 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.51 -6.63 83.09 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.347 -169.583 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.03 122.05 7.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.497 1.119 . . . . 0.0 109.501 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.2 m -152.33 172.45 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.812 0.845 . . . . 0.0 110.248 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.3 mt -93.39 116.75 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 167.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.483 HD11 ' HB3' ' A' ' 51' ' ' LEU . 1.4 mp -76.32 123.0 31.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 124.596 1.158 . . . . 0.0 109.302 177.6 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -97.75 122.01 40.33 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -157.94 117.18 3.22 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 123.314 0.646 . . . . 0.0 109.639 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.5 m120 66.88 16.97 10.49 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.78 1.232 . . . . 0.0 111.92 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.39 75.04 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 122.989 0.328 . . . . 0.0 113.069 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -90.46 156.98 17.81 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.751 0.82 . . . . 0.0 110.206 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.23 126.02 38.2 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.742 0.817 . . . . 0.0 109.717 -177.122 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.7 136.79 27.66 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.178 0.591 . . . . 0.0 109.655 177.244 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -84.63 123.98 30.95 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.039 0.935 . . . . 0.0 109.301 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.484 HD11 ' HB3' ' A' ' 59' ' ' LEU . 59.2 tp -119.5 136.8 54.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.599 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -139.76 143.83 37.13 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.499 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.527 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.4 mtpm? -83.02 98.99 9.56 Favored 'General case' 0 C--N 1.347 0.478 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.416 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -63.63 139.26 58.75 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -74.0 1.55 10.67 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -175.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.97 -18.79 63.37 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.548 0.739 . . . . 0.0 110.838 164.791 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.63 33.42 4.15 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.903 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.416 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.6 mtpt -134.94 -178.07 4.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.7 0.8 . . . . 0.0 111.253 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.484 ' HB3' HD11 ' A' ' 51' ' ' LEU . 69.8 mt -108.24 166.46 10.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.312 1.045 . . . . 0.0 109.99 169.141 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.4 tp -152.33 106.16 3.11 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.39 101.1 13.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -103.91 164.46 11.68 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.244 1.018 . . . . 0.0 108.991 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.255 1.347 0 CA-C-O 118.631 -0.699 . . . . 0.0 109.435 176.912 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 tpp . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m 62.38 16.24 8.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.295 1.038 . . . . 0.0 113.504 171.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.513 ' HA ' ' HB2' ' A' ' 6' ' ' ASN . 98.0 mtt180 -92.31 -11.7 34.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.236 0.614 . . . . 0.0 112.646 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -61.19 -37.32 82.54 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.21 0.528 . . . . 0.0 109.756 174.437 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -134.04 94.68 3.29 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . 0.513 ' HB2' ' HA ' ' A' ' 3' ' ' ARG . 62.1 t30 -124.57 158.92 31.83 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.998 0.919 . . . . 0.0 108.809 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.4 m -69.17 110.19 4.43 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.043 0.537 . . . . 0.0 111.323 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -77.24 159.62 29.5 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.706 0.802 . . . . 0.0 109.035 171.551 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.9 mt -59.98 110.65 2.99 Favored Pre-proline 0 N--CA 1.481 1.077 0 C-N-CA 123.276 0.63 . . . . 0.0 111.317 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -92.71 166.12 2.71 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.853 2.369 . . . . 0.0 112.346 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -146.88 111.89 4.16 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 123.864 0.865 . . . . 0.0 109.65 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -74.79 155.48 43.95 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.749 2.299 . . . . 0.0 111.343 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.461 ' HZ2' ' HB3' ' A' ' 13' ' ' LYS . 2.8 mmmp? -106.26 -179.23 3.88 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.839 0.855 . . . . 0.0 110.836 -179.929 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -76.17 96.01 3.8 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.51 0.724 . . . . 0.0 109.618 -175.512 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.7 108.15 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.055 0.942 . . . . 0.0 110.519 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.7 t70 70.88 139.1 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.48 1.512 . . . . 0.0 112.72 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -139.76 27.29 2.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.586 0.754 . . . . 0.0 110.706 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -69.69 131.88 45.28 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.403 0.281 . . . . 0.0 111.577 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -117.29 110.35 17.98 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.516 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -71.72 157.81 37.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.492 0.663 . . . . 0.0 110.961 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.2 tp -84.81 121.78 74.5 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.242 -171.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.56 119.28 6.3 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 121.907 1.738 . . . . 0.0 110.751 172.561 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.69 -47.32 67.3 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 124.054 0.942 . . . . 0.0 112.093 -173.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -168.07 140.45 3.03 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.079 0.952 . . . . 0.0 109.448 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.36 24.91 4.71 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.619 0.723 . . . . 0.0 109.526 169.519 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -70.55 78.62 0.58 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.706 1.602 . . . . 0.0 110.143 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -81.36 91.07 6.21 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.755 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 m -122.76 154.13 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.64 1.176 . . . . 0.0 109.565 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -60.33 155.52 17.72 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.558 0.743 . . . . 0.0 111.111 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.494 ' HA ' HG22 ' A' ' 42' ' ' ILE . 48.3 p -51.44 -25.19 5.91 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.031 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -66.66 -25.71 66.7 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.422 0.63 . . . . 0.0 111.306 177.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.53 32.99 4.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.709 1.204 . . . . 0.0 110.469 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -50.03 -18.32 0.53 Allowed 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 124.593 1.157 . . . . 0.0 114.09 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.467 HD23 ' HG3' ' A' ' 53' ' ' LYS . 96.1 mt -126.4 -49.55 1.54 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.64 0.776 . . . . 0.0 109.715 170.535 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.08 -152.96 46.03 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-N 115.563 -0.744 . . . . 0.0 113.589 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.43 -17.0 21.47 Favored 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 122.682 2.255 . . . . 0.0 112.296 173.795 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -76.73 -38.78 53.66 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.192 0.997 . . . . 0.0 110.222 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.59 -0.24 70.97 Favored Glycine 0 C--N 1.347 1.178 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.953 -171.808 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.8 106.24 1.08 Allowed 'General case' 0 C--N 1.351 0.673 0 C-N-CA 124.427 1.091 . . . . 0.0 108.861 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.9 m -138.73 169.66 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.919 0.888 . . . . 0.0 110.034 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -91.76 109.02 20.72 Favored 'Isoleucine or valine' 0 C--O 1.243 0.756 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 164.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.494 HG22 ' HA ' ' A' ' 30' ' ' SER . 54.4 mt -61.12 132.41 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.033 0.933 . . . . 0.0 109.694 174.344 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -116.73 120.8 39.71 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 174.317 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . 0.406 ' HB2' ' HB3' ' A' ' 30' ' ' SER . 57.0 t60 -160.85 118.26 2.39 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.487 0.315 . . . . 0.0 111.269 -176.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 t30 55.65 51.1 13.1 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.178 1.391 . . . . 0.0 111.68 171.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.43 -18.89 12.29 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.317 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -105.39 144.08 32.67 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.52 0.728 . . . . 0.0 110.232 -173.674 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.415 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.0 pt-20 -134.43 138.42 44.78 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.922 0.489 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -151.56 136.2 17.06 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.121 0.968 . . . . 0.0 110.236 -172.444 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.82 113.31 13.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.707 0.803 . . . . 0.0 109.957 -178.376 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 56.9 tp -104.29 138.8 40.21 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 169.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -141.29 146.66 37.06 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 111.058 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.55 ' HZ2' ' HB3' ' A' ' 53' ' ' LYS . 9.4 mtpm? -78.64 107.64 11.46 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 167.294 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.7 p -67.33 130.07 41.89 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.734 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.44 -20.07 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 123.852 0.72 . . . . 0.0 111.148 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.44 -24.57 63.64 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.994 0.918 . . . . 0.0 111.187 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.03 43.03 0.88 Allowed Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.492 173.244 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -144.62 -174.39 4.31 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.102 0.561 . . . . 0.0 110.486 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.8 mt -116.07 142.93 46.15 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.669 1.188 . . . . 0.0 108.739 169.706 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -126.74 107.23 9.97 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -90.89 125.92 35.9 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 173.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -141.39 167.74 21.43 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.154 1.382 . . . . 0.0 108.491 -176.991 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? . . . . . 0 C--O 1.25 1.09 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 172.136 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.5 t -155.81 154.87 32.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.776 1.23 . . . . 0.0 108.674 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.75 -15.86 24.77 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.214 0.606 . . . . 0.0 109.609 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mpt? 65.0 166.7 0.17 Allowed 'General case' 0 C--N 1.362 1.133 0 C-N-CA 125.307 1.443 . . . . 0.0 112.197 -178.46 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -128.85 151.23 49.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.064 178.839 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -160.53 146.14 14.87 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -77.48 147.73 35.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.915 0.486 . . . . 0.0 110.545 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -100.56 170.41 8.39 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.454 0.702 . . . . 0.0 110.665 -177.472 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.26 152.6 81.78 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.382 1.073 . . . . 0.0 110.242 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.11 174.27 13.09 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.944 2.43 . . . . 0.0 113.267 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -67.29 142.41 96.73 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 123.889 0.876 . . . . 0.0 110.721 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -62.32 138.06 69.28 Favored 'Trans proline' 0 C--N 1.378 2.112 0 C-N-CA 122.809 2.34 . . . . 0.0 111.995 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -81.23 150.17 28.72 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.563 0.745 . . . . 0.0 111.139 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 144.27 47.41 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.308 0.643 . . . . 0.0 110.02 177.719 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 52.5 mt -99.22 -34.64 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.874 0.47 . . . . 0.0 111.862 -172.578 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -54.98 136.47 47.62 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -173.592 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.34 27.74 0.66 Allowed 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -120.59 -30.4 4.52 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.912 -166.644 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 75.7 p -79.45 66.74 5.0 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 121.961 0.886 . . . . 0.0 110.961 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.2 mt -88.38 169.34 11.89 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 124.192 0.997 . . . . 0.0 109.459 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.67 142.14 98.11 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 122.865 0.466 . . . . 0.0 110.473 -179.332 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -54.52 165.1 2.55 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.428 2.752 . . . . 0.0 113.371 177.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.3 -34.54 73.93 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.08 0.467 . . . . 0.0 111.031 175.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.59 173.54 14.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.879 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.34 38.57 1.55 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 122.012 0.91 . . . . 0.0 109.454 172.295 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.407 ' NH1' HG13 ' A' ' 40' ' ' VAL . 29.0 ttt180 -82.33 95.75 7.71 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.939 173.542 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.78 95.01 3.94 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 m -131.36 158.2 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.03 0.932 . . . . 0.0 109.342 175.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -62.09 158.58 16.34 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.134 0.897 . . . . 0.0 110.913 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.5 t -54.12 -22.39 10.97 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.713 1.205 . . . . 0.0 113.813 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -58.39 -38.87 78.22 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.099 0.56 . . . . 0.0 110.915 175.538 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.03 36.37 2.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.981 0.913 . . . . 0.0 110.596 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.03 -24.12 6.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 124.553 1.141 . . . . 0.0 113.948 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -130.33 -69.52 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.107 0.563 . . . . 0.0 109.653 174.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.26 -161.6 50.15 Favored Glycine 0 CA--C 1.533 1.179 0 O-C-N 123.996 0.81 . . . . 0.0 112.071 -172.478 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.93 -11.83 31.39 Favored 'Trans proline' 0 C--N 1.37 1.706 0 C-N-CA 122.759 2.306 . . . . 0.0 112.448 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.39 -49.95 61.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.146 0.978 . . . . 0.0 109.662 174.818 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.47 3.58 78.15 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.877 -1.056 . . . . 0.0 113.36 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -161.62 110.46 1.52 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.239 1.016 . . . . 0.0 108.29 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.407 HG13 ' NH1' ' A' ' 26' ' ' ARG . 3.1 m -147.08 167.53 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 123.013 0.525 . . . . 0.0 110.334 179.772 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.1 mt -90.54 108.03 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 166.811 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.512 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.32 135.25 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.634 1.174 . . . . 0.0 109.41 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -115.69 127.06 54.88 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 124.521 1.128 . . . . 0.0 108.472 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -165.79 123.37 1.48 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.846 0.858 . . . . 0.0 109.688 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 67.3 26.77 8.46 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.588 1.155 . . . . 0.0 110.725 173.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.84 16.24 79.38 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.121 -176.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -114.96 133.67 55.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.061 0.944 . . . . 0.0 108.833 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.512 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -116.55 133.22 56.27 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.122 0.969 . . . . 0.0 110.541 -174.031 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -140.7 125.26 17.86 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -79.64 106.05 11.39 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 59.9 tp -101.99 131.36 48.45 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 173.553 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -138.4 140.34 39.31 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 123.836 0.71 . . . . 0.0 110.306 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -84.63 112.16 20.2 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 173.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.469 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 9.6 p -74.53 148.22 41.09 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.72 -8.61 44.34 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 124.17 0.919 . . . . 0.0 112.692 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.9 -3.83 37.54 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.591 0.757 . . . . 0.0 111.505 169.748 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.89 38.91 7.75 Favored Glycine 0 C--N 1.353 1.504 0 C-N-CA 123.355 0.503 . . . . 0.0 112.12 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.469 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 22.8 mtpp -130.97 -178.48 4.84 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.155 0.582 . . . . 0.0 110.675 -174.12 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.7 mt -111.3 156.24 21.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.46 1.104 . . . . 0.0 109.39 169.281 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.3 tp -144.76 101.57 3.67 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 176.098 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -84.56 114.73 22.18 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 174.462 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.7 p -126.45 154.79 43.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.502 1.121 . . . . 0.0 108.565 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.921 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.408 0.147 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 m -60.54 117.12 4.91 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.735 0.814 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -95.25 145.93 24.71 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.466 0.706 . . . . 0.0 110.075 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 80.0 mtp -72.3 142.48 48.86 Favored 'General case' 0 C--O 1.242 0.659 0 O-C-N 124.01 0.819 . . . . 0.0 109.045 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.56 156.03 27.75 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.643 0.589 . . . . 0.0 111.563 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.47 153.7 34.64 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.163 0.585 . . . . 0.0 111.143 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.9 m -75.38 74.18 2.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.129 0.972 . . . . 0.0 111.792 -170.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 54.3 -171.32 0.05 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.145 1.378 . . . . 0.0 112.91 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 pp -75.59 159.71 80.96 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 169.248 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.95 130.11 25.01 Favored 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 121.583 1.522 . . . . 0.0 110.793 174.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -68.24 143.06 95.43 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 123.301 0.376 . . . . 0.0 110.124 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.62 156.08 38.98 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.753 2.302 . . . . 0.0 113.065 173.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -95.81 153.66 17.63 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 123.861 0.865 . . . . 0.0 109.564 178.28 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -61.42 113.26 2.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.447 0.699 . . . . 0.0 110.348 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 31.6 mt -91.24 103.81 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.364 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -82.34 -170.29 2.85 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 170.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -127.87 64.57 1.37 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 56.77 84.77 0.09 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.134 1.373 . . . . 0.0 111.744 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.9 m -65.62 134.01 52.37 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.136 -178.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -79.24 162.13 25.89 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.533 0.733 . . . . 0.0 110.432 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mp -109.1 145.49 31.86 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 123.843 0.857 . . . . 0.0 109.786 -177.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.8 144.77 60.46 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 122.414 2.076 . . . . 0.0 111.04 171.13 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.99 74.78 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.46 0.475 . . . . 0.0 110.179 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.01 117.54 1.21 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 123.848 0.717 . . . . 0.0 109.637 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.58 69.58 7.11 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.807 0.843 . . . . 0.0 109.196 173.597 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -125.67 88.73 2.91 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.594 0.758 . . . . 0.0 109.114 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.1 mtp85 -81.33 90.39 6.14 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.523 0.678 . . . . 0.0 110.375 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.5 m -121.34 157.73 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.758 1.223 . . . . 0.0 109.173 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -64.62 156.93 28.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.569 0.747 . . . . 0.0 110.148 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.8 t -56.41 -20.16 18.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.362 1.065 . . . . 0.0 113.787 -174.553 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -54.88 -40.85 70.18 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.771 0.828 . . . . 0.0 111.372 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.78 40.31 1.4 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.491 1.116 . . . . 0.0 110.347 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -48.08 -18.53 0.2 Allowed 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.574 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 86.0 mt -117.25 -33.49 4.64 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.538 0.608 . . . . 0.0 110.963 176.748 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.66 -145.61 45.68 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-O 118.939 -0.923 . . . . 0.0 112.465 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -88.1 -13.41 3.75 Favored 'Trans proline' 0 C--N 1.369 1.64 0 C-N-CA 122.98 2.453 . . . . 0.0 112.92 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -91.72 -29.15 16.98 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.591 0.757 . . . . 0.0 111.538 -173.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.574 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 86.11 0.67 86.99 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -165.101 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -146.46 119.74 8.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.729 1.212 . . . . 0.0 109.197 -176.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.444 HG21 HD11 ' A' ' 42' ' ' ILE . 35.7 m -151.1 171.6 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.137 0.975 . . . . 0.0 109.601 178.135 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 62.1 mt -91.35 106.54 17.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 168.805 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.444 HD11 HG21 ' A' ' 40' ' ' VAL . 1.6 mp -68.48 137.08 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 124.726 1.21 . . . . 0.0 109.926 176.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -112.4 126.57 55.43 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 169.882 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -164.47 140.68 6.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 173.731 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 66.55 14.76 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.097 1.359 . . . . 0.0 111.442 -175.688 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.29 -5.38 72.84 Favored Glycine 0 C--N 1.352 1.459 0 C-N-CA 123.329 0.49 . . . . 0.0 112.8 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -95.76 161.46 14.01 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.408 1.083 . . . . 0.0 109.782 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.45 138.52 54.01 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.333 0.653 . . . . 0.0 110.14 -178.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 140.21 26.16 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.04 122.72 30.46 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.477 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -114.07 135.1 54.39 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 167.222 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -138.86 137.8 36.88 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.505 0.503 . . . . 0.0 111.094 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.596 ' HZ3' ' HB3' ' A' ' 53' ' ' LYS . 9.8 mtpm? -79.01 102.38 8.31 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 169.951 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.533 ' HG1' ' HB2' ' A' ' 58' ' ' LYS . 24.3 p -65.74 140.28 58.43 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.049 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -75.44 -0.59 20.57 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.126 0.489 . . . . 0.0 111.676 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.93 -1.51 22.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.895 0.878 . . . . 0.0 111.236 163.804 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.32 35.57 8.68 Favored Glycine 0 C--N 1.35 1.356 0 C-N-CA 124.018 0.818 . . . . 0.0 112.571 174.337 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.533 ' HB2' ' HG1' ' A' ' 54' ' ' THR . 47.3 mtmt -133.96 173.85 11.12 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.667 0.387 . . . . 0.0 111.362 -174.413 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.477 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.6 mt -110.15 136.18 49.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.939 1.295 . . . . 0.0 109.274 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.33 98.7 5.55 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -92.8 104.67 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -115.28 126.78 54.91 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.613 1.165 . . . . 0.0 108.88 175.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.909 -175.972 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -91.56 98.57 11.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.099 0.56 . . . . 0.0 109.87 -177.976 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -120.41 -77.66 0.58 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.982 0.913 . . . . 0.0 109.346 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.1 ttt -88.28 87.03 7.17 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.86 77.88 7.7 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -84.43 154.4 22.8 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.968 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 48.1 m -71.96 137.13 47.09 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -59.82 145.08 46.79 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.787 0.835 . . . . 0.0 110.25 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.19 112.77 9.94 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.044 0.938 . . . . 0.0 109.643 178.812 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -56.65 127.29 25.28 Favored 'Trans proline' 0 C--N 1.382 2.331 0 C-N-CA 122.926 2.417 . . . . 0.0 112.313 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -61.29 142.55 93.51 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.417 0.687 . . . . 0.0 109.908 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -58.97 111.9 1.04 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.665 2.243 . . . . 0.0 110.631 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -59.84 98.66 0.06 Allowed 'General case' 0 C--N 1.358 0.965 0 O-C-N 124.007 0.817 . . . . 0.0 110.622 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.8 135.64 33.3 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.959 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -109.47 99.32 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.618 0.767 . . . . 0.0 109.187 178.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -158.04 109.93 2.29 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -80.22 103.01 9.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.489 0.716 . . . . 0.0 110.568 -177.312 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -95.75 -3.74 45.29 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.749 0.82 . . . . 0.0 110.756 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.1 p -64.54 148.04 51.58 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.879 0.872 . . . . 0.0 110.99 174.363 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.3 mt -73.98 153.35 39.78 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.332 0.653 . . . . 0.0 111.264 -174.784 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.81 141.72 33.86 Favored Pre-proline 0 N--CA 1.477 0.921 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.715 -173.702 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.62 150.62 63.25 Favored 'Trans proline' 0 C--N 1.386 2.501 0 C-N-CA 122.69 2.26 . . . . 0.0 111.932 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HB2' HD11 ' A' ' 50' ' ' LEU . . . -72.63 -42.32 64.56 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.756 0.423 . . . . 0.0 111.819 -176.648 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.09 163.97 28.34 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.208 0.603 . . . . 0.0 110.735 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.02 24.58 8.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 110.13 172.276 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -81.28 93.71 6.59 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.919 0.487 . . . . 0.0 110.874 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 102.46 4.43 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.3 m -123.32 157.61 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.705 1.202 . . . . 0.0 108.136 168.999 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.509 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 7.1 p30 -74.03 167.05 22.3 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 122.941 0.151 . . . . 0.0 110.675 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -48.56 -30.94 5.81 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -172.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -62.81 -31.86 72.93 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 118.503 0.592 . . . . 0.0 111.197 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.86 30.07 5.39 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.391 1.077 . . . . 0.0 110.202 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.523 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.6 pt? -48.94 -29.33 4.64 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.523 1.129 . . . . 0.0 113.833 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.523 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 93.3 mt -130.97 -69.92 0.62 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 109.735 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.9 -151.66 52.12 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.932 -174.0 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.27 -13.66 25.59 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 122.523 2.148 . . . . 0.0 112.437 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.7 -60.49 2.21 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.167 0.987 . . . . 0.0 110.397 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.72 -17.33 45.73 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-N 114.822 -1.081 . . . . 0.0 113.178 -175.937 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -136.45 99.38 4.07 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.654 0.782 . . . . 0.0 110.108 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.69 165.3 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 124.02 0.928 . . . . 0.0 109.468 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.457 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 54.6 mt -90.19 118.54 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.257 0.623 . . . . 0.0 109.666 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 mp -78.56 131.09 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.972 1.309 . . . . 0.0 110.009 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.509 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 12.2 t70 -104.13 122.29 45.01 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 124.894 1.277 . . . . 0.0 107.781 171.35 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -156.98 110.53 2.61 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.31 0.644 . . . . 0.0 109.366 -175.46 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 61.65 28.25 17.46 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.155 0.982 . . . . 0.0 111.375 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.54 -9.35 76.15 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.862 -0.608 . . . . 0.0 113.464 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -81.18 138.38 35.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.445 0.698 . . . . 0.0 109.972 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.45 124.75 52.91 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.879 0.871 . . . . 0.0 108.69 177.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 8.7 p90 -152.6 125.07 8.23 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.81 0.444 . . . . 0.0 112.054 177.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.508 HD11 ' HB2' ' A' ' 23' ' ' ALA . 3.2 tm? -77.93 115.54 17.74 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.611 1.165 . . . . 0.0 109.455 -173.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.437 HD11 ' HB3' ' A' ' 59' ' ' LEU . 36.0 tp -104.56 131.17 52.28 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 171.893 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.7 ptm180 -134.52 134.31 41.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.043 0.839 . . . . 0.0 110.688 -175.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.551 ' HZ3' ' HB3' ' A' ' 53' ' ' LYS . 9.8 mtpm? -82.74 103.9 12.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.481 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.2 p -64.93 144.01 57.57 Favored 'General case' 0 C--O 1.253 1.254 0 O-C-N 123.968 0.793 . . . . 0.0 109.362 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -68.87 -11.63 60.73 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.358 1.063 . . . . 0.0 112.146 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.93 -0.87 17.47 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.933 0.893 . . . . 0.0 111.431 169.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.96 44.53 7.62 Favored Glycine 0 C--N 1.354 1.53 0 C-N-CA 123.585 0.612 . . . . 0.0 112.2 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -139.39 174.97 9.97 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 122.555 0.342 . . . . 0.0 110.748 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.437 ' HB3' HD11 ' A' ' 51' ' ' LEU . 80.9 mt -109.14 135.27 50.55 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.351 1.061 . . . . 0.0 109.957 171.919 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -125.0 106.34 9.88 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -89.13 100.95 13.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.65 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 67.3 p -108.91 159.76 16.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 C--O 1.252 1.191 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.981 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mmm . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.7 t -89.49 108.01 19.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -144.75 8.46 1.29 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.497 0.719 . . . . 0.0 111.197 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.82 114.19 28.19 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.061 0.944 . . . . 0.0 109.307 177.637 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -100.72 -5.67 26.13 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.424 0.69 . . . . 0.0 110.738 174.67 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -78.92 149.71 32.31 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.297 0.639 . . . . 0.0 109.368 171.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.5 m -79.11 91.47 4.92 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -71.99 132.53 44.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.281 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.5 mt -86.07 114.65 58.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 123.232 0.613 . . . . 0.0 109.749 -173.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.19 123.79 14.68 Favored 'Trans proline' 0 C--N 1.385 2.476 0 C-N-CA 123.458 2.772 . . . . 0.0 113.362 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 -116.59 89.6 28.3 Favored Pre-proline 0 CA--C 1.56 1.353 0 C-N-CA 123.301 0.641 . . . . 0.0 110.27 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.68 130.35 3.19 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 122.742 2.294 . . . . 0.0 112.345 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -146.77 142.23 27.54 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 122.939 0.496 . . . . 0.0 110.494 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -66.7 107.7 2.23 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.287 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.22 83.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.243 0.617 . . . . 0.0 109.762 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -168.76 108.7 0.49 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 107.509 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.69 34.76 4.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 44.7 32.8 0.83 Allowed 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 125.956 1.702 . . . . 0.0 112.786 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.6 m -64.44 128.53 36.18 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.116 0.966 . . . . 0.0 111.179 -173.475 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.8 -173.84 2.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.967 0.907 . . . . 0.0 111.845 -177.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.6 mp -59.22 138.79 88.37 Favored Pre-proline 0 CA--C 1.556 1.175 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.31 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.455 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 1.6 Cg_endo -40.72 -55.36 2.01 Favored 'Trans proline' 0 C--N 1.391 2.766 0 C-N-CA 124.654 3.569 . . . . 0.0 113.09 -177.311 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.508 ' HB3' HD22 ' A' ' 50' ' ' LEU . . . 175.75 -60.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 173.788 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -153.2 143.25 22.24 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.208 -1.36 . . . . 0.0 109.262 172.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -86.3 30.96 0.67 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.467 0.707 . . . . 0.0 111.571 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.454 ' HG3' HG12 ' A' ' 28' ' ' VAL . 7.8 tpp180 -87.96 92.87 9.29 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.097 0.559 . . . . 0.0 109.616 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -79.72 103.76 9.84 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.189 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.454 HG12 ' HG3' ' A' ' 26' ' ' ARG . 20.8 m -110.88 154.1 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.617 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -52.44 150.13 5.13 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.481 0.712 . . . . 0.0 111.02 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' SER . . . . . 0.513 ' HA ' HG23 ' A' ' 42' ' ' ILE . 15.5 m -47.24 -35.17 7.32 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -58.09 -32.32 67.96 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.902 0.881 . . . . 0.0 112.202 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.66 31.23 4.86 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.284 1.034 . . . . 0.0 111.75 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -46.2 -22.83 0.27 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -178.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -125.31 -68.9 0.81 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.472 0.709 . . . . 0.0 109.923 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.78 -153.59 51.54 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 113.457 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -70.5 -16.65 34.46 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.983 2.456 . . . . 0.0 112.247 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.56 -56.64 3.75 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.834 0.854 . . . . 0.0 110.167 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.9 -10.01 64.12 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-N 114.799 -1.091 . . . . 0.0 113.397 -175.538 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.558 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -136.41 73.53 1.46 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.198 0.999 . . . . 0.0 110.708 -175.826 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 19.6 m -135.88 161.15 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.008 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.523 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 35.1 mt -86.83 121.79 38.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.08 -178.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.513 HG23 ' HA ' ' A' ' 30' ' ' SER . 48.8 mt -69.6 105.9 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.798 0.839 . . . . 0.0 109.39 173.944 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -87.16 121.52 29.73 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 172.653 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -147.46 95.71 2.58 Favored 'General case' 0 C--O 1.241 0.658 0 O-C-N 123.869 0.731 . . . . 0.0 110.035 -175.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 23.6 m120 58.42 45.15 17.13 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.422 1.089 . . . . 0.0 112.034 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.84 -26.41 6.02 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 113.709 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.71 107.7 15.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -101.42 138.56 38.27 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.641 0.776 . . . . 0.0 109.675 178.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.602 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -147.69 126.43 12.61 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.544 0.737 . . . . 0.0 109.035 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.9 tm? -71.71 126.14 28.94 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.115 0.566 . . . . 0.0 110.382 -174.458 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.553 HD12 ' HB3' ' A' ' 59' ' ' LEU . 37.0 tp -117.15 119.74 36.15 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 172.093 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.558 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.9 ptm180 -126.6 136.27 52.31 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.944 0.402 . . . . 0.0 110.616 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -76.36 99.6 4.88 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.5 p -64.39 138.2 58.29 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -72.38 -7.11 47.95 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 124.764 1.29 . . . . 0.0 111.341 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.76 -18.76 62.76 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.888 0.875 . . . . 0.0 111.088 168.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.89 38.33 2.2 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.984 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -140.78 176.75 8.54 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.305 0.574 . . . . 0.0 111.428 -174.727 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.553 ' HB3' HD12 ' A' ' 51' ' ' LEU . 78.1 mt -108.15 136.58 47.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 109.133 169.543 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -119.34 103.69 9.71 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -91.42 124.75 35.84 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.6 p -136.72 120.54 17.43 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.1 0.96 . . . . 0.0 108.981 -174.385 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.602 ' HD3' ' HB3' ' A' ' 49' ' ' TYR . 35.1 mmtp . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.021 0.928 . . . . 0.0 109.819 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.449 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.483 1.224 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.7 p -85.02 78.15 9.96 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.629 0.772 . . . . 0.0 111.087 -174.707 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.15 79.8 1.3 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 170.058 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 ptp -104.96 97.8 7.61 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.957 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -87.37 100.33 12.65 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.151 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.22 149.0 48.82 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.444 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -154.29 154.81 34.03 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 123.388 0.675 . . . . 0.0 109.843 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -97.73 153.68 18.09 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.268 1.027 . . . . 0.0 109.269 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -76.44 153.93 83.88 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 122.82 0.448 . . . . 0.0 111.444 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -56.12 132.3 51.1 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.926 2.417 . . . . 0.0 112.108 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -96.69 161.47 26.49 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 123.936 0.895 . . . . 0.0 110.459 -177.577 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -48.93 146.8 11.27 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.317 2.678 . . . . 0.0 113.837 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -73.22 160.32 32.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.408 0.683 . . . . 0.0 112.303 -175.12 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.48 141.04 35.59 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.357 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.9 mt -128.1 99.86 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -132.21 70.14 1.47 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -91.79 96.96 10.7 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.216 -177.673 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -137.62 15.61 2.93 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 124.162 0.985 . . . . 0.0 110.157 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 25.1 p -75.89 100.31 4.77 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.517 0.727 . . . . 0.0 110.936 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -91.74 161.97 14.66 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.775 0.83 . . . . 0.0 110.283 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.2 mt -106.47 139.98 20.86 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.597 0.759 . . . . 0.0 110.267 -176.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.93 161.12 23.05 Favored 'Trans proline' 0 C--N 1.383 2.39 0 C-N-CA 123.071 2.514 . . . . 0.0 112.617 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.427 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -56.85 -56.91 15.5 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.752 0.821 . . . . 0.0 112.672 -172.975 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -166.01 114.67 0.95 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.12 0.568 . . . . 0.0 110.76 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.17 100.23 4.22 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-O 121.992 0.901 . . . . 0.0 109.442 175.043 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -150.61 91.22 1.71 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 108.865 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.74 86.78 3.36 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.447 -176.297 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.8 m -101.33 167.58 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.451 1.1 . . . . 0.0 108.048 172.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -55.01 149.22 12.19 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.589 0.756 . . . . 0.0 111.343 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 t -58.71 -26.12 63.59 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.33 0.652 . . . . 0.0 111.609 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -60.49 -35.72 76.61 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.757 0.823 . . . . 0.0 110.983 172.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.54 30.54 3.54 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.193 0.997 . . . . 0.0 110.972 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -47.03 -28.44 1.68 Allowed 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.918 1.287 . . . . 0.0 114.324 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.447 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 88.7 mt -121.37 -56.12 1.91 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.499 0.72 . . . . 0.0 109.376 175.419 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.25 -151.75 50.23 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.333 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.86 -13.13 14.51 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.535 2.157 . . . . 0.0 112.496 172.681 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.58 -43.44 15.67 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.672 0.789 . . . . 0.0 110.488 -177.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.447 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 79.0 4.32 88.66 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.449 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.433 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 17.3 ptpt -151.59 75.23 1.16 Allowed 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.756 0.789 . . . . 0.0 110.387 -173.155 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -141.46 169.6 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.124 -175.331 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.417 HG21 ' HB2' ' A' ' 48' ' ' GLU . 23.0 mt -91.59 125.08 44.32 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 CA-C-O 121.499 0.666 . . . . 0.0 110.9 -178.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.583 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -62.96 134.8 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.839 1.656 . . . . 0.0 109.464 168.57 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -114.72 115.52 27.21 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 163.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -126.73 87.23 2.62 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.1 t30 66.66 22.43 10.44 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 124.617 1.167 . . . . 0.0 110.766 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.57 -4.99 56.79 Favored Glycine 0 C--N 1.351 1.416 0 O-C-N 121.772 -0.58 . . . . 0.0 113.333 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -81.55 108.08 14.83 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.583 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 9.8 pt-20 -98.25 135.21 40.21 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.477 0.486 . . . . 0.0 111.303 -174.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -145.71 125.9 13.82 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 123.555 0.742 . . . . 0.0 110.021 175.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -78.91 103.18 8.68 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.565 0.62 . . . . 0.0 109.55 176.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.0 tp -96.72 132.33 42.51 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 17.1 ptm180 -138.7 137.75 37.09 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 123.54 0.525 . . . . 0.0 111.214 -175.247 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -81.47 99.23 8.64 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.43 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 17.1 p -67.7 142.47 56.31 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 123.899 0.749 . . . . 0.0 109.412 -177.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -64.01 -16.35 61.43 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 124.877 1.361 . . . . 0.0 112.004 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.08 -7.63 31.06 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.174 0.99 . . . . 0.0 112.459 171.452 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.02 42.66 5.9 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.687 0.661 . . . . 0.0 112.007 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.43 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.8 mtpt -140.98 177.84 7.78 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.092 0.557 . . . . 0.0 110.479 -172.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.2 mt -114.24 143.61 44.57 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.646 1.178 . . . . 0.0 109.198 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.518 ' HG ' HG21 ' A' ' 62' ' ' THR . 17.9 tp -132.98 105.32 7.01 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.692 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -89.61 102.11 14.79 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' THR . . . . . 0.518 HG21 ' HG ' ' A' ' 60' ' ' LEU . 25.6 p -129.14 123.13 31.34 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.9 0.88 . . . . 0.0 109.913 -175.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.465 ' HD3' ' O ' ' A' ' 48' ' ' GLU . 24.1 tptp . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptp . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 t -164.14 -64.71 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.851 0.86 . . . . 0.0 109.004 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -98.22 -71.67 0.68 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.987 0.915 . . . . 0.0 109.88 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.9 mmt -137.92 164.7 28.35 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.661 1.184 . . . . 0.0 109.468 -174.921 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -78.35 135.85 37.56 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.312 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -80.75 94.45 6.4 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.17 0.588 . . . . 0.0 110.409 -174.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -161.54 152.64 18.36 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.33 0.652 . . . . 0.0 109.842 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -135.96 152.83 51.37 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.308 1.043 . . . . 0.0 109.246 177.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.62 124.37 90.83 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 122.944 0.497 . . . . 0.0 109.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.72 145.41 63.17 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.632 2.221 . . . . 0.0 112.604 -175.247 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -75.56 119.9 79.19 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.46 0.704 . . . . 0.0 109.538 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.44 138.33 38.57 Favored 'Trans proline' 0 C--N 1.372 1.803 0 C-N-CA 122.617 2.211 . . . . 0.0 111.739 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.63 120.08 13.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.133 0.573 . . . . 0.0 110.776 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.3 132.29 34.64 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 169.333 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 63.4 mt -79.81 120.47 31.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.458 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -134.12 95.01 3.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.34 1.056 . . . . 0.0 108.793 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -76.56 -8.12 56.57 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.931 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -65.49 132.84 49.92 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.841 1.256 . . . . 0.0 110.026 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t -140.41 160.96 38.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.645 0.778 . . . . 0.0 109.641 -178.428 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.7 mt -85.69 148.39 25.91 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.821 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp -125.82 86.01 58.29 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.967 0.907 . . . . 0.0 109.135 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.45 -69.47 0.03 OUTLIER 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.18 1.92 . . . . 0.0 110.643 170.123 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.509 ' HB2' HD21 ' A' ' 50' ' ' LEU . . . 167.32 -58.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 126.53 1.932 . . . . 0.0 106.813 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.44 118.15 1.91 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.72 1.208 . . . . 0.0 108.518 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -71.05 90.39 0.84 Allowed 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.149 0.58 . . . . 0.0 109.587 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -139.01 84.2 2.0 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.09 0.956 . . . . 0.0 108.883 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -75.94 86.18 2.87 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.341 0.591 . . . . 0.0 110.24 -177.664 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -109.93 149.11 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 124.468 1.107 . . . . 0.0 108.216 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -51.83 157.87 1.12 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.591 1.156 . . . . 0.0 112.702 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -54.05 -28.05 36.27 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.209 1.004 . . . . 0.0 113.301 179.491 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -62.12 -34.98 77.36 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.999 0.428 . . . . 0.0 110.654 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.4 35.59 2.08 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.589 1.156 . . . . 0.0 110.695 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -47.71 -21.53 0.39 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.9 mt -130.49 -43.3 1.14 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.256 0.623 . . . . 0.0 109.917 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.63 -158.6 51.21 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.62 -175.667 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.95 -14.47 15.33 Favored 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 169.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -79.2 -35.42 41.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.878 0.871 . . . . 0.0 111.077 -174.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.0 -11.13 63.35 Favored Glycine 0 C--N 1.352 1.453 0 N-CA-C 114.665 0.626 . . . . 0.0 114.665 171.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -149.58 85.9 1.45 Allowed 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.054 0.927 . . . . 0.0 110.183 -179.727 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -131.58 171.32 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.393 0.677 . . . . 0.0 110.462 -171.512 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.413 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 32.9 mt -99.91 123.22 52.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 123.183 0.593 . . . . 0.0 109.805 176.868 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.508 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -73.55 122.7 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 124.896 1.279 . . . . 0.0 109.011 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -93.59 123.03 36.64 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.279 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -148.63 96.71 2.63 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.706 0.802 . . . . 0.0 109.959 -177.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 59.15 30.94 20.83 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.576 1.151 . . . . 0.0 112.15 172.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.11 -22.3 39.89 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-O 119.698 -0.501 . . . . 0.0 113.397 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -83.6 153.53 24.26 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.508 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.8 pt-20 -133.92 135.3 43.5 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.166 0.291 . . . . 0.0 110.617 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -135.52 113.9 11.56 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.509 HD21 ' HB2' ' A' ' 23' ' ' ALA . 3.3 tm? -70.21 110.59 5.29 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 175.305 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.405 HD13 ' HB3' ' A' ' 59' ' ' LEU . 52.4 tp -106.56 118.62 37.13 Favored 'General case' 0 C--O 1.249 1.041 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.485 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.6 ptm180 -123.6 137.05 54.82 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.979 0.512 . . . . 0.0 110.76 -177.794 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.623 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.0 mtpm? -78.47 99.32 6.39 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 170.327 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.46 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -69.58 142.84 53.48 Favored 'General case' 0 C--O 1.251 1.174 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -69.44 -10.3 57.39 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.105 0.962 . . . . 0.0 111.602 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.61 -24.41 67.56 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.572 0.749 . . . . 0.0 110.948 167.08 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.94 37.53 2.71 Favored Glycine 0 C--N 1.35 1.307 0 C-N-CA 124.358 0.98 . . . . 0.0 111.733 -179.559 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.46 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.9 mtpt -135.02 176.04 9.03 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.444 0.64 . . . . 0.0 111.524 -172.641 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.405 ' HB3' HD13 ' A' ' 51' ' ' LEU . 49.8 mt -109.58 141.71 41.69 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.035 -1.438 . . . . 0.0 107.405 163.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 tp -131.5 103.08 6.21 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -88.54 113.19 23.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 p -137.63 142.03 41.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.534 1.134 . . . . 0.0 108.884 -175.485 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 122.972 0.509 . . . . 0.0 109.653 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtm . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t 50.6 76.81 0.14 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.248 1.419 . . . . 0.0 112.86 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -84.44 -57.44 3.15 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.886 0.474 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.1 ttt 66.1 126.81 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.11 1.364 . . . . 0.0 112.748 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.12 132.53 36.6 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -115.52 111.44 20.73 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.597 0.759 . . . . 0.0 109.285 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -68.2 146.76 53.08 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 175.314 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -120.25 157.22 29.6 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 122.821 0.448 . . . . 0.0 111.916 -167.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -64.66 154.67 84.38 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.54 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -53.91 101.56 0.07 OUTLIER 'Trans proline' 0 C--N 1.384 2.44 0 C-N-CA 123.36 2.706 . . . . 0.0 112.507 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -81.81 144.63 52.29 Favored Pre-proline 0 N--CA 1.473 0.712 0 C-N-CA 123.298 0.639 . . . . 0.0 110.515 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.23 164.86 21.69 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.205 1.937 . . . . 0.0 111.804 171.518 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -155.7 106.56 2.5 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 123.541 0.736 . . . . 0.0 109.256 177.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 66.31 100.87 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.201 1.4 . . . . 0.0 111.182 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 61.9 mt -83.18 122.21 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.92 0.888 . . . . 0.0 111.298 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t70 73.91 153.06 0.14 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 125.012 1.325 . . . . 0.0 113.472 167.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -96.5 23.58 6.7 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.143 0.977 . . . . 0.0 112.135 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -57.13 135.79 56.38 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.459 0.704 . . . . 0.0 112.059 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 m -116.53 104.0 10.97 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.15 157.7 32.5 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.878 0.471 . . . . 0.0 110.445 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.1 mt -76.59 151.32 82.73 Favored Pre-proline 0 CA--C 1.545 0.788 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.076 -177.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.84 156.15 24.63 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 123.007 2.471 . . . . 0.0 112.626 170.201 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.01 -21.63 32.22 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 123.898 0.879 . . . . 0.0 112.999 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.99 161.1 41.48 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.402 1.081 . . . . 0.0 108.933 171.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.422 ' O ' ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -111.07 29.59 7.65 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.894 0.854 . . . . 0.0 109.238 168.886 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -82.25 86.23 6.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.778 0.831 . . . . 0.0 109.947 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.422 ' HD3' ' O ' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -77.15 87.5 3.61 Favored 'General case' 0 C--N 1.36 1.023 0 CA-C-O 121.091 0.472 . . . . 0.0 110.185 177.949 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.5 m -101.86 154.35 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 173.501 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -58.6 150.55 22.78 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.097 0.559 . . . . 0.0 109.764 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 p -51.04 -25.05 4.33 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -175.698 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -56.29 -38.73 71.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.82 0.848 . . . . 0.0 111.506 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.37 36.29 2.19 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.969 0.908 . . . . 0.0 110.777 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.453 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -46.39 -26.26 0.8 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.558 1.543 . . . . 0.0 115.029 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.453 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 97.5 mt -127.38 -54.34 1.36 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 122.824 0.45 . . . . 0.0 110.089 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 -158.46 53.39 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.488 -175.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -78.21 -7.55 16.16 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.372 2.048 . . . . 0.0 112.031 172.47 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.92 -48.35 13.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.459 1.104 . . . . 0.0 110.467 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.22 -12.9 61.16 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.898 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.401 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -142.9 89.46 2.12 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 117.579 0.69 . . . . 0.0 110.761 -177.791 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.3 m -140.56 163.01 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 123.213 0.605 . . . . 0.0 110.363 -175.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . 0.537 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 25.7 mt -88.49 125.41 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -81.15 119.57 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.246 1.419 . . . . 0.0 109.329 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -103.19 115.4 30.5 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.059 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -161.99 142.07 10.15 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.158 0.983 . . . . 0.0 108.729 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . 0.428 ' HB2' HE21 ' A' ' 47' ' ' GLN . 17.6 m-80 70.18 12.61 7.69 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.554 1.542 . . . . 0.0 111.611 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.0 83.09 Favored Glycine 0 C--N 1.345 1.034 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 -170.738 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.428 HE21 ' HB2' ' A' ' 45' ' ' ASN . 40.6 mt-30 -111.15 158.05 19.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.348 1.059 . . . . 0.0 108.683 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.74 125.86 27.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 122.811 0.444 . . . . 0.0 110.435 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -148.5 126.78 12.21 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 111.273 -174.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.537 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 3.3 tm? -75.29 122.74 24.17 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.855 1.262 . . . . 0.0 110.722 -172.602 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 59' ' ' LEU . 54.9 tp -111.29 127.04 55.5 Favored 'General case' 0 C--O 1.245 0.866 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 167.952 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.417 ' HD3' HD21 ' A' ' 60' ' ' LEU . 16.9 ptm180 -128.24 142.93 51.02 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.71 0.631 . . . . 0.0 110.564 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.411 ' HD2' HD13 ' A' ' 34' ' ' LEU . 27.5 mtpp -83.59 104.88 14.07 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.717 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.2 p -71.4 134.23 46.5 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 172.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -72.98 -0.64 14.33 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.964 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.15 -14.21 61.76 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.953 0.901 . . . . 0.0 110.715 166.891 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.82 35.15 4.11 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.501 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -139.42 173.52 11.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.006 0.523 . . . . 0.0 111.289 -174.376 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.486 ' HB3' HD13 ' A' ' 51' ' ' LEU . 59.7 mt -111.26 144.42 40.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.301 1.04 . . . . 0.0 109.242 174.725 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . 0.417 HD21 ' HD3' ' A' ' 52' ' ' ARG . 16.3 tp -132.47 113.83 13.58 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -177.263 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.76 124.52 35.95 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.485 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 80.9 p -142.39 -169.59 3.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.155 1.782 . . . . 0.0 106.534 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.489 ' HA ' ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 121.548 -0.72 . . . . 0.0 110.577 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.402 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.7 m -68.3 -66.4 0.57 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.003 0.521 . . . . 0.0 110.723 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? 62.68 -80.56 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.906 1.282 . . . . 0.0 109.435 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 65.2 mtt -139.6 107.75 5.76 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 170.351 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.66 -57.04 14.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.612 0.765 . . . . 0.0 111.986 -177.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.1 t30 66.09 136.31 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.574 1.549 . . . . 0.0 112.454 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.7 t -141.6 151.19 42.93 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 123.642 0.777 . . . . 0.0 109.477 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -108.89 139.55 43.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.817 0.847 . . . . 0.0 109.816 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.8 mp -81.26 129.02 68.37 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.211 0.604 . . . . 0.0 109.869 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.64 150.31 70.72 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.941 2.427 . . . . 0.0 112.918 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -86.78 148.5 46.03 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 122.878 0.471 . . . . 0.0 110.882 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.86 178.97 3.52 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 0.0 112.331 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 141.6 58.1 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.502 0.721 . . . . 0.0 111.811 -177.701 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 126.65 28.4 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.525 0.73 . . . . 0.0 110.836 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.2 mt -114.53 109.06 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.381 0.672 . . . . 0.0 109.424 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -82.75 147.96 28.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.251 171.473 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -91.23 33.83 0.96 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.566 0.746 . . . . 0.0 111.146 178.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 63.81 98.99 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 125.722 1.609 . . . . 0.0 112.249 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 t -70.79 125.33 26.52 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 121.061 0.458 . . . . 0.0 109.967 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.6 mt -92.24 172.99 8.05 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.478 0.711 . . . . 0.0 109.818 178.204 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.56 153.21 93.69 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.62 0.768 . . . . 0.0 111.572 -177.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -52.02 150.21 19.14 Favored 'Trans proline' 0 C--N 1.386 2.503 0 C-N-CA 123.253 2.636 . . . . 0.0 112.961 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.476 ' HB2' ' HD3' ' A' ' 39' ' ' LYS . . . -57.15 -44.37 83.34 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.275 0.63 . . . . 0.0 111.587 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . 0.475 ' HB2' ' O ' ' A' ' 39' ' ' LYS . . . -164.58 118.8 1.37 Allowed 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.748 0.819 . . . . 0.0 109.606 172.262 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -77.83 85.52 4.1 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 122.036 0.922 . . . . 0.0 109.789 177.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.403 ' HG3' HG11 ' A' ' 28' ' ' VAL . 19.7 tpp180 -137.47 90.08 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.719 -178.526 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -74.85 89.66 2.35 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.529 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.403 HG11 ' HG3' ' A' ' 26' ' ' ARG . 23.5 m -112.61 161.11 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.006 1.323 . . . . 0.0 109.214 172.699 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.46 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 58.5 t30 -69.66 160.62 31.25 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.401 0.68 . . . . 0.0 109.972 175.351 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.5 m -50.04 -27.56 5.74 Favored 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 124.45 1.1 . . . . 0.0 113.89 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -57.27 -34.59 68.81 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.59 0.756 . . . . 0.0 111.694 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.59 40.83 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.106 0.962 . . . . 0.0 110.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -50.56 -20.25 1.12 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -132.21 -54.2 0.97 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.301 0.64 . . . . 0.0 109.317 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.79 -144.46 45.28 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.974 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -79.85 -12.48 13.43 Favored 'Trans proline' 0 C--N 1.376 2.016 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.95 -42.9 13.65 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.572 -174.992 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.69 3.07 86.8 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.697 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.476 ' HD3' ' HB2' ' A' ' 23' ' ' ALA . 8.4 ptpp? -160.58 109.82 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.2 m -148.57 174.92 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 123.701 0.8 . . . . 0.0 111.011 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.8 mt -98.63 108.95 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 C-N-CA 124.127 0.971 . . . . 0.0 109.306 172.24 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.491 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -71.72 135.39 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.142 1.377 . . . . 0.0 110.427 176.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.46 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 15.8 t70 -103.71 120.77 41.6 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 169.889 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -160.42 115.38 2.25 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 123.956 0.785 . . . . 0.0 110.004 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 m120 61.88 28.31 17.28 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.805 1.242 . . . . 0.0 111.838 -178.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.49 -7.69 56.78 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.564 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . 0.424 ' HB2' ' HH ' ' A' ' 49' ' ' TYR . 52.6 mt-30 -93.13 137.89 32.06 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.903 0.881 . . . . 0.0 108.646 -177.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.491 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 16.2 pt-20 -108.72 129.92 55.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.137 0.575 . . . . 0.0 109.933 -178.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.424 ' HH ' ' HB2' ' A' ' 47' ' ' GLN . 1.3 m-85 -127.07 125.54 41.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.975 0.51 . . . . 0.0 109.658 -179.61 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.95 100.71 5.68 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -98.75 124.86 43.87 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -131.24 140.17 49.79 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.103 0.561 . . . . 0.0 110.261 -177.776 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -76.68 112.44 13.25 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 166.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 10.4 p -70.32 146.39 50.57 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -67.63 -9.46 43.29 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.435 1.094 . . . . 0.0 111.679 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.97 5.27 16.82 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.218 1.007 . . . . 0.0 111.448 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.53 40.46 15.36 Favored Glycine 0 C--N 1.353 1.492 0 C-N-CA 123.431 0.539 . . . . 0.0 112.702 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.0 mtpt -133.75 -171.4 2.71 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 122.816 0.446 . . . . 0.0 110.401 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 mt -114.88 163.91 14.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.943 0.897 . . . . 0.0 109.96 168.909 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.8 tp -152.18 103.05 2.83 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -90.96 102.15 14.92 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 178.915 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 74.4 p -118.04 153.72 33.23 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.339 0.655 . . . . 0.0 109.793 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptm . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 m -128.4 170.53 13.01 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.761 0.824 . . . . 0.0 110.165 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 68.89 5.67 5.14 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 125.417 1.487 . . . . 0.0 113.16 176.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.8 mtm -121.0 14.9 11.56 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.8 0.84 . . . . 0.0 112.018 -172.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -151.29 136.14 17.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.165 0.586 . . . . 0.0 110.209 178.285 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -106.33 168.17 9.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.988 0.915 . . . . 0.0 110.805 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.8 p -70.41 159.87 33.39 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.797 0.839 . . . . 0.0 112.272 179.203 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -61.57 142.68 56.94 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.429 1.091 . . . . 0.0 111.161 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.5 mt -107.52 92.05 7.96 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.093 0.957 . . . . 0.0 108.506 173.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -85.4 -164.38 0.23 Allowed 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.921 2.414 . . . . 0.0 112.002 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 63.3 94.33 0.05 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.922 1.289 . . . . 0.0 110.779 177.172 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -79.06 179.85 6.1 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.583 2.189 . . . . 0.0 111.898 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.75 172.16 9.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.363 0.665 . . . . 0.0 109.23 174.701 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -66.79 103.8 1.19 Allowed 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.226 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 56.8 mt -63.01 86.88 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.43 1.092 . . . . 0.0 111.368 -169.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.2 t70 58.25 -82.8 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.056 1.343 . . . . 0.0 111.399 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -158.97 27.18 0.21 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.297 1.046 . . . . 0.0 109.19 176.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -97.4 109.07 21.9 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.217 -176.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.2 t -74.34 172.74 11.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.162 0.585 . . . . 0.0 110.371 178.916 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.3 mt -88.94 -155.69 0.35 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.854 0.861 . . . . 0.0 110.744 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -58.58 147.6 69.38 Favored Pre-proline 0 N--CA 1.485 1.325 0 C-N-CA 123.724 0.81 . . . . 0.0 111.631 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.63 168.32 23.99 Favored 'Trans proline' 0 C--N 1.383 2.369 0 C-N-CA 122.972 2.448 . . . . 0.0 112.254 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.23 -58.33 3.35 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.865 0.466 . . . . 0.0 110.962 -176.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.11 148.03 9.82 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.69 0.796 . . . . 0.0 110.375 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . 0.453 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 48.7 mt-10 -113.8 35.53 4.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.716 0.806 . . . . 0.0 109.702 174.358 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . 0.442 ' HG3' HG12 ' A' ' 28' ' ' VAL . 14.3 tpt180 -82.82 85.39 7.1 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.539 178.058 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . 0.453 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 6.5 mpt_? -74.28 94.67 2.53 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.135 0.493 . . . . 0.0 109.855 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . 0.442 HG12 ' HG3' ' A' ' 26' ' ' ARG . 34.6 m -107.81 172.3 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.863 1.265 . . . . 0.0 108.377 171.459 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.417 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 5.0 m-20 -69.15 165.35 20.59 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.94 0.496 . . . . 0.0 111.497 176.522 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -59.24 -32.4 69.94 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.939 0.895 . . . . 0.0 110.991 168.959 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -55.94 -33.88 65.14 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.059 173.764 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.95 35.08 3.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.125 0.97 . . . . 0.0 111.046 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -46.78 -20.18 0.12 Allowed 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.463 HD23 ' HG3' ' A' ' 53' ' ' LYS . 95.2 mt -130.89 -56.65 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.299 0.64 . . . . 0.0 109.761 172.993 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.83 -158.05 53.07 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.037 -177.23 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -76.76 -10.31 18.4 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.873 2.382 . . . . 0.0 112.274 173.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -75.0 -51.87 12.53 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.787 0.835 . . . . 0.0 109.5 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.69 0.1 88.86 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.851 -176.199 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -154.14 98.05 2.11 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.9 m -143.29 166.62 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 122.945 0.498 . . . . 0.0 110.929 -173.625 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.7 mt -98.31 117.7 43.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.136 168.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -67.79 133.47 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 125.854 1.662 . . . . 0.0 110.112 174.746 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . 0.417 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 19.2 t70 -104.25 113.3 26.76 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -155.15 113.8 3.54 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.397 0.436 . . . . 0.0 111.092 -175.421 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.67 36.98 22.54 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.414 1.486 . . . . 0.0 110.646 172.615 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.64 -25.01 12.07 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.442 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -91.99 156.79 17.19 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.949 0.5 . . . . 0.0 110.03 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -134.5 129.73 35.6 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.337 -174.836 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -134.19 133.29 40.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 122.4 -0.187 . . . . 0.0 110.508 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.61 110.98 12.88 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.491 HD13 ' HB3' ' A' ' 59' ' ' LEU . 60.9 tp -108.07 127.12 53.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 170.173 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.94 144.73 51.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.093 0.473 . . . . 0.0 110.342 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.463 ' HG3' HD23 ' A' ' 34' ' ' LEU . 60.3 mtpt -83.75 98.53 9.74 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 169.839 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.6 p -63.78 139.64 58.79 Favored 'General case' 0 C--O 1.246 0.901 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -64.92 -12.66 51.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.431 1.082 . . . . 0.0 112.331 -176.092 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.64 -13.36 62.3 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.52 0.728 . . . . 0.0 111.569 171.207 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.02 37.74 4.56 Favored Glycine 0 C--N 1.349 1.288 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.153 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -132.36 165.25 24.65 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.669 0.388 . . . . 0.0 110.402 -175.157 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.491 ' HB3' HD13 ' A' ' 51' ' ' LEU . 76.1 mt -100.97 142.3 32.64 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.725 0.81 . . . . 0.0 109.158 167.532 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.4 tp -130.97 104.18 6.97 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.079 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -93.29 101.59 13.84 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.5 p -115.91 152.44 33.44 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.563 1.145 . . . . 0.0 109.355 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.422 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.785 0.834 . . . . 0.0 108.802 -177.539 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.415 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.4 mpt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.849 0.356 . . . . 0.0 110.288 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.2 t -84.32 173.23 11.12 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.33 0.652 . . . . 0.0 109.258 171.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.594 ' HG3' ' SD ' ' A' ' 4' ' ' MET . 21.8 tpt180 -127.41 -89.24 0.54 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' MET . . . . . 0.594 ' SD ' ' HG3' ' A' ' 3' ' ' ARG . 1.9 mpt? -139.48 108.48 6.02 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.889 0.876 . . . . 0.0 108.657 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -165.48 167.22 17.75 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.573 0.749 . . . . 0.0 110.575 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -163.63 155.21 16.89 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.679 0.792 . . . . 0.0 110.0 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -64.14 104.88 0.79 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.989 0.916 . . . . 0.0 111.124 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -126.03 -170.33 2.17 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.496 1.119 . . . . 0.0 109.521 179.213 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.1 mt 67.23 102.33 0.04 OUTLIER Pre-proline 0 N--CA 1.487 1.388 0 C-N-CA 124.419 1.088 . . . . 0.0 109.949 -177.04 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -68.87 139.68 44.05 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.676 2.251 . . . . 0.0 112.165 -173.352 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 53.9 m80 -77.33 133.23 68.25 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.85 134.17 60.82 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.875 2.383 . . . . 0.0 112.41 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -111.49 16.44 20.74 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.115 0.966 . . . . 0.0 110.028 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 68.92 118.04 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.867 1.267 . . . . 0.0 110.385 -173.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.4 mt -84.57 68.31 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 68.3 148.13 0.06 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 125.585 1.554 . . . . 0.0 111.12 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.9 86.79 7.12 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -99.33 149.26 23.32 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.847 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 t -158.49 151.51 22.59 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.084 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.8 mt -87.95 159.84 18.16 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -117.21 95.0 46.43 Favored Pre-proline 0 C--O 1.242 0.681 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.183 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -65.38 -75.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.381 2.263 0 C-N-CA 122.484 2.123 . . . . 0.0 110.614 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 174.31 -56.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.979 1.312 . . . . 0.0 108.503 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.58 128.91 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.107 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -86.24 79.46 9.07 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.739 0.816 . . . . 0.0 109.94 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -142.42 96.15 2.9 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.93 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.7 mtm105 -85.32 96.95 9.69 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.212 0.53 . . . . 0.0 109.937 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -112.8 168.6 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.375 1.07 . . . . 0.0 108.899 171.662 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -57.26 159.51 4.52 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.512 0.725 . . . . 0.0 111.758 177.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.9 p -56.85 -27.39 60.26 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.901 0.88 . . . . 0.0 111.544 168.898 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.94 -37.3 76.4 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.863 0.865 . . . . 0.0 110.884 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -106.26 37.09 2.37 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.666 0.786 . . . . 0.0 110.869 174.672 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.51 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -49.55 -20.29 0.73 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LEU . . . . . 0.532 HD11 ' HD2' ' A' ' 53' ' ' LYS . 94.6 mt -126.22 -42.6 1.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.13 0.572 . . . . 0.0 110.299 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.66 -158.9 43.18 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.993 -176.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -79.07 -4.99 14.27 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.641 2.227 . . . . 0.0 112.189 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.89 -33.52 19.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.582 1.153 . . . . 0.0 110.876 -178.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.65 -4.32 60.83 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.81 -173.356 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.24 105.07 2.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.692 0.797 . . . . 0.0 110.357 -175.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.9 m -148.55 171.54 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.663 0.785 . . . . 0.0 110.05 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.0 mt -89.5 119.35 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 123.247 0.619 . . . . 0.0 109.799 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.69 137.62 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.498 1.519 . . . . 0.0 109.263 172.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -126.01 122.39 35.74 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 170.852 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -158.0 110.56 2.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.783 0.433 . . . . 0.0 111.101 -177.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.37 30.94 20.71 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 125.015 1.326 . . . . 0.0 111.6 173.256 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -18.98 56.49 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.675 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -91.25 128.6 37.13 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.8 135.47 52.97 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.476 0.71 . . . . 0.0 109.97 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -139.01 164.43 29.78 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -103.63 126.62 50.89 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.237 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.5 HD13 ' HB3' ' A' ' 59' ' ' LEU . 37.3 tp -120.36 122.1 40.05 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 170.73 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -122.12 138.6 54.4 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.638 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LYS . . . . . 0.563 ' HB3' ' HZ1' ' A' ' 53' ' ' LYS . 9.0 mtpm? -82.72 117.3 22.55 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 171.583 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.49 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 23.6 p -74.87 147.65 40.88 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -67.14 -12.99 61.51 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.6 -6.54 31.83 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.884 0.874 . . . . 0.0 111.859 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.23 37.94 7.47 Favored Glycine 0 C--N 1.355 1.613 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' LYS . . . . . 0.49 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 54.8 mtpt -136.54 -169.5 2.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.418 0.687 . . . . 0.0 110.405 -171.636 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LEU . . . . . 0.5 ' HB3' HD13 ' A' ' 51' ' ' LEU . 78.6 mt -118.33 166.38 12.7 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.753 1.221 . . . . 0.0 109.979 176.906 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.5 tp -153.43 103.75 2.69 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -93.99 101.76 13.82 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -177.664 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.6 p -118.03 133.31 56.03 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.208 1.003 . . . . 0.0 109.861 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.59 0.233 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.98 155.4 20.94 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 124.299 0.999 . . . . 0.0 109.243 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -108.49 23.32 14.7 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.525 ' HG3' HG13 ' A' ' 28' ' ' VAL . 17.6 tpp180 -88.55 95.98 10.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.375 0.67 . . . . 0.0 110.721 -176.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.57 90.22 4.52 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.863 0.465 . . . . 0.0 110.038 174.605 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.525 HG13 ' HG3' ' A' ' 26' ' ' ARG . 16.4 m -103.28 152.78 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.628 0.771 . . . . 0.0 109.438 170.065 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -62.02 157.13 19.49 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.583 0.753 . . . . 0.0 111.73 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 31.5 t -44.44 -40.59 5.62 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.962 1.705 . . . . 0.0 115.278 -174.73 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -64.22 -27.68 69.22 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 118.356 0.525 . . . . 0.0 111.44 -175.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.78 30.86 3.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.338 1.055 . . . . 0.0 111.007 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -48.3 -27.7 2.68 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.088 1.355 . . . . 0.0 114.439 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.6 mt -132.03 -53.27 0.98 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 -146.55 50.42 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.848 -172.519 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.31 -2.85 8.62 Favored 'Trans proline' 0 C--N 1.371 1.726 0 C-N-CA 122.582 2.188 . . . . 0.0 112.376 168.757 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -80.74 -60.1 2.43 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 123.822 0.849 . . . . 0.0 110.394 -176.585 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.28 -28.85 12.25 Favored Glycine 0 C--N 1.349 1.259 0 CA-C-O 119.662 -0.521 . . . . 0.0 114.37 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -134.43 95.42 3.38 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.109 0.954 . . . . 0.0 111.387 -177.304 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -143.11 161.36 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.396 0.678 . . . . 0.0 110.037 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 34.4 mt -89.72 124.83 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 C-N-CA 123.183 0.593 . . . . 0.0 109.62 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.513 HG23 ' HA ' ' A' ' 30' ' ' SER . 1.3 mp -81.86 119.45 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 C-N-CA 125.135 1.374 . . . . 0.0 109.438 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -96.24 109.44 21.92 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 175.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 49.6 t-80 -165.35 148.28 8.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.9 0.88 . . . . 0.0 109.872 -174.135 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 69.04 23.48 6.54 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.396 1.079 . . . . 0.0 111.142 171.319 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.48 24.32 76.19 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.909 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -138.6 177.98 7.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.855 1.262 . . . . 0.0 109.494 -175.767 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -134.32 149.34 50.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.765 0.826 . . . . 0.0 108.866 169.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.677 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 3.6 p90 -158.84 125.59 4.71 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.493 0.717 . . . . 0.0 111.159 176.639 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -75.24 115.83 15.31 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.184 0.994 . . . . 0.0 109.843 -172.899 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 59' ' ' LEU . 55.7 tp -109.97 124.39 51.34 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 8.0 ptm180 -129.93 152.21 49.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.027 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -90.56 108.31 19.72 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 p -72.57 136.63 45.85 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -60.25 -27.23 67.06 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.177 0.991 . . . . 0.0 112.218 -174.095 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.46 -22.79 55.85 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.186 0.994 . . . . 0.0 112.039 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.51 41.31 0.96 Allowed Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.626 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -137.01 172.68 12.65 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.318 0.58 . . . . 0.0 111.79 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.8 mt -106.84 148.26 28.74 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.158 169.664 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.9 tp -137.92 99.59 3.94 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -89.69 122.47 32.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 177.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.6 p -135.16 131.66 37.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.615 0.766 . . . . 0.0 109.766 -174.332 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.677 ' HD2' ' HB3' ' A' ' 49' ' ' TYR . 30.3 mmmt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.261 1.024 . . . . 0.0 108.701 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 120.87 0.367 . . . . 0.0 111.488 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.39 159.04 19.22 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.798 1.239 . . . . 0.0 108.95 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -114.12 22.49 13.79 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.311 0.577 . . . . 0.0 109.865 171.408 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -85.47 103.22 14.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.11 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -79.75 107.82 12.82 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.5 m -122.56 153.17 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -62.75 164.75 7.4 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.968 0.507 . . . . 0.0 111.932 -174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.2 m -55.35 -33.76 63.66 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.934 0.894 . . . . 0.0 112.916 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.87 -32.47 69.51 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.155 0.982 . . . . 0.0 111.776 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -105.04 31.25 4.96 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.576 1.15 . . . . 0.0 111.443 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.461 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.5 pt? -45.51 -24.64 0.34 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -174.563 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.53 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 82.4 mt -123.05 -58.52 1.64 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.658 0.663 . . . . 0.0 111.227 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.71 -155.36 46.57 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 123.849 0.718 . . . . 0.0 112.906 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -73.64 -16.03 24.11 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 123.023 2.482 . . . . 0.0 112.001 172.365 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -79.63 -54.51 5.81 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.27 1.028 . . . . 0.0 110.73 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 82.47 3.48 90.51 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.482 -171.5 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.514 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -147.96 89.58 1.75 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.203 1.001 . . . . 0.0 110.009 -177.26 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 m -145.35 170.8 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.787 0.835 . . . . 0.0 110.537 -176.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 26.0 mt -94.33 112.31 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 123.409 0.683 . . . . 0.0 109.913 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -70.8 115.89 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.754 1.621 . . . . 0.0 110.476 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.44 104.05 16.22 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 171.345 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -102.63 86.53 2.79 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 168.06 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.0 m120 55.08 55.46 7.63 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.175 1.39 . . . . 0.0 111.329 176.602 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.9 -26.33 13.25 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.682 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.37 106.05 13.93 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 10.2 pt-20 -101.8 124.48 47.52 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.211 0.604 . . . . 0.0 111.443 -171.507 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.656 ' HB3' ' HB3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.32 135.34 38.82 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.914 0.886 . . . . 0.0 109.633 178.192 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -78.26 129.55 35.2 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 59' ' ' LEU . 61.0 tp -122.98 136.63 54.93 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.606 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -141.09 142.63 34.11 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.365 0.416 . . . . 0.0 111.796 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -78.69 102.83 8.25 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.348 0.659 . . . . 0.0 109.497 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -73.47 133.75 43.74 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -70.47 -8.25 49.63 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 124.011 0.82 . . . . 0.0 110.702 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.92 -18.29 59.77 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.562 1.145 . . . . 0.0 111.718 167.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.51 34.35 3.89 Favored Glycine 0 C--N 1.344 0.973 0 C-N-CA 123.414 0.53 . . . . 0.0 112.74 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -144.08 175.22 10.21 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.334 0.588 . . . . 0.0 111.47 -175.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.631 ' HB3' HD11 ' A' ' 51' ' ' LEU . 30.8 mt -106.86 146.97 30.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.751 1.221 . . . . 0.0 108.858 165.537 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -132.86 102.23 5.56 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.407 0.683 . . . . 0.0 109.203 -175.883 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -88.94 103.23 15.84 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 43.8 p -109.03 135.02 50.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.674 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HB3' ' HB3' ' A' ' 49' ' ' TYR . 22.6 pttm . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 123.65 0.78 . . . . 0.0 110.326 -176.046 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.54 149.55 9.87 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.161 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 35.0 mt-10 -100.45 28.53 4.97 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.962 0.905 . . . . 0.0 111.325 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -81.06 92.52 6.24 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.486 0.714 . . . . 0.0 111.099 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.472 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 11.1 mpt_? -74.48 106.77 6.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 174.193 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 m -140.5 145.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.782 1.233 . . . . 0.0 109.374 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' ASP . 59.8 t30 -60.95 159.95 10.58 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 -178.716 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.2 m -43.03 -30.43 0.43 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 174.699 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -55.49 -42.64 74.69 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.488 0.661 . . . . 0.0 111.175 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.94 37.54 1.94 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.557 1.143 . . . . 0.0 110.841 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.562 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -54.33 -22.46 12.18 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.536 HD13 ' HD2' ' A' ' 53' ' ' LYS . 96.0 mt -134.65 -52.53 0.81 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.253 0.549 . . . . 0.0 109.554 174.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.67 -152.26 50.33 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.024 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.35 3.8 6.7 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.83 2.353 . . . . 0.0 112.837 170.03 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.13 -58.16 2.56 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.595 0.758 . . . . 0.0 109.873 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.55 -22.91 29.55 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.364 -0.686 . . . . 0.0 113.779 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -133.67 101.27 5.05 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-N 118.493 1.147 . . . . 0.0 111.276 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.4 m -142.07 167.83 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 121.816 -0.552 . . . . 0.0 111.335 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.435 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 59.8 mt -92.68 111.62 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.47 1.108 . . . . 0.0 108.868 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -80.77 111.24 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.162 0.985 . . . . 0.0 109.663 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 29' ' ' ASN . 19.3 t70 -89.11 122.13 32.12 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.885 1.274 . . . . 0.0 107.935 174.163 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -171.48 143.55 1.8 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.276 0.63 . . . . 0.0 110.723 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.0 t30 62.92 21.34 12.81 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 124.696 1.198 . . . . 0.0 112.18 170.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.06 -4.49 78.01 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 121.872 -0.517 . . . . 0.0 113.527 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -120.26 171.7 8.31 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.718 0.771 . . . . 0.0 111.512 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.435 ' HB2' ' CG2' ' A' ' 41' ' ' ILE . 1.0 OUTLIER -129.82 137.73 50.62 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.294 179.556 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.509 ' HD1' ' HE3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -137.18 118.1 14.23 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.513 0.725 . . . . 0.0 109.087 -178.723 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -76.5 103.41 6.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.426 0.69 . . . . 0.0 109.235 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.462 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -104.68 118.74 37.33 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -123.85 134.51 53.57 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 123.764 0.665 . . . . 0.0 109.859 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.6 mtpm? -79.31 99.25 7.02 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 173.187 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -62.69 136.62 57.97 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 176.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -70.42 -4.83 24.42 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.636 0.774 . . . . 0.0 111.704 -177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.35 -11.84 60.17 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.57 1.148 . . . . 0.0 112.071 166.06 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.58 40.07 5.13 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 123.539 0.59 . . . . 0.0 112.289 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -140.89 170.84 14.99 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.87 0.468 . . . . 0.0 110.726 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD11 ' A' ' 51' ' ' LEU . 72.1 mt -106.78 139.73 40.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.479 1.112 . . . . 0.0 109.498 172.795 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -127.12 100.95 6.32 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.82 113.79 25.41 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.5 p -130.31 -179.12 5.07 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.972 1.309 . . . . 0.0 108.17 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HE3' ' HD1' ' A' ' 49' ' ' TYR . 46.1 mmtm . . . . . 0 C--O 1.251 1.168 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 CA-C-O 120.896 0.379 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.63 149.23 26.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.841 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.43 24.13 13.17 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.721 0.808 . . . . 0.0 109.366 171.104 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -83.31 90.24 7.11 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.177 0.991 . . . . 0.0 110.123 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -77.58 96.49 4.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.2 m -119.99 156.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.431 1.092 . . . . 0.0 109.198 171.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -59.27 155.74 13.83 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.941 0.896 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -51.93 -26.81 11.15 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.584 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.6 -35.83 73.05 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.445 0.698 . . . . 0.0 111.701 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.71 40.63 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.946 0.898 . . . . 0.0 109.908 177.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -47.17 -16.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 177.188 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.526 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.1 mt -119.17 -32.18 4.48 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 121.728 -0.608 . . . . 0.0 110.636 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.25 -166.26 37.89 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.958 -177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.21 -10.32 19.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 122.631 2.22 . . . . 0.0 112.097 173.853 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -91.65 -24.12 19.63 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.785 0.834 . . . . 0.0 110.625 -175.496 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.46 -6.29 73.6 Favored Glycine 0 C--N 1.35 1.357 0 O-C-N 123.165 0.291 . . . . 0.0 112.592 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.63 110.2 3.8 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.136 0.974 . . . . 0.0 108.956 -177.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.2 m -146.75 171.89 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.448 0.699 . . . . 0.0 110.742 -176.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.6 mt -92.54 116.12 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.457 171.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.46 136.11 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 125.21 1.404 . . . . 0.0 109.505 174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -115.03 118.34 33.13 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 124.406 1.082 . . . . 0.0 108.404 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -152.45 113.81 4.27 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.458 0.473 . . . . 0.0 111.065 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 t30 63.54 28.9 15.34 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.821 1.248 . . . . 0.0 111.044 171.779 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.51 2.55 87.15 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.452 -0.794 . . . . 0.0 114.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -111.02 128.57 55.9 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.838 0.855 . . . . 0.0 109.086 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 15.4 pt-20 -113.02 137.82 50.82 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.284 0.634 . . . . 0.0 110.957 -175.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -135.31 149.53 49.78 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -100.35 109.51 21.69 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.854 0.752 . . . . 0.0 109.071 177.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 59' ' ' LEU . 51.0 tp -107.34 125.85 51.72 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.09 135.66 48.48 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 123.915 0.76 . . . . 0.0 110.54 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.526 ' HD2' HD13 ' A' ' 34' ' ' LEU . 62.0 mtpt -77.01 108.01 9.77 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.744 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -72.29 139.53 48.07 Favored 'General case' 0 C--O 1.249 1.039 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -74.07 -4.72 37.24 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.7 0.625 . . . . 0.0 111.015 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.8 -23.85 67.37 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 110.789 165.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.1 36.99 2.05 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.349 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -134.12 177.66 7.57 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.313 0.578 . . . . 0.0 111.413 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.493 ' HB3' HD11 ' A' ' 51' ' ' LEU . 89.6 mt -114.07 138.86 49.84 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.135 1.374 . . . . 0.0 108.35 169.546 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -133.28 102.27 5.49 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -174.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -86.06 121.8 29.18 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.9 p -130.49 158.62 39.44 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.996 0.918 . . . . 0.0 109.643 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 124.157 0.983 . . . . 0.0 109.01 -177.777 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.58 -172.72 2.51 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 124.446 1.092 . . . . 0.0 110.398 175.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.25 27.17 8.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.323 1.049 . . . . 0.0 109.95 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -72.63 76.64 1.09 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.255 1.022 . . . . 0.0 109.524 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.42 ' HA ' ' HB ' ' A' ' 41' ' ' ILE . 2.7 ttm180 -82.91 86.23 6.99 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -171.966 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.5 m -113.67 154.0 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.227 1.011 . . . . 0.0 109.763 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.39 152.08 11.97 Favored 'General case' 0 CA--C 1.555 1.168 0 O-C-N 123.716 0.635 . . . . 0.0 111.042 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -50.04 -24.98 2.98 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -58.22 -33.4 69.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.729 0.412 . . . . 0.0 111.587 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.48 35.3 3.12 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.456 1.102 . . . . 0.0 110.401 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -53.62 -19.01 3.4 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.464 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.0 mt -133.11 -65.91 0.68 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 168.765 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.0 -155.29 53.15 Favored Glycine 0 CA--C 1.533 1.188 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.465 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -80.8 2.8 8.28 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 123.035 2.49 . . . . 0.0 112.828 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -97.79 -59.0 1.86 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.342 1.057 . . . . 0.0 109.465 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.27 -11.16 65.5 Favored Glycine 0 C--N 1.347 1.143 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HD2' ' O ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -141.54 78.74 1.65 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 122.866 1.317 . . . . 0.0 110.868 -175.839 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.98 159.94 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.773 -168.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 27' ' ' ARG . 50.7 mt -90.15 110.58 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.766 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.35 105.15 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.634 1.174 . . . . 0.0 109.997 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.3 121.7 24.77 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 166.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -145.83 100.3 3.39 Favored 'General case' 0 C--O 1.239 0.537 0 O-C-N 124.038 0.836 . . . . 0.0 109.101 -177.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 61.61 23.24 13.58 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.152 1.381 . . . . 0.0 111.641 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.79 -22.35 40.0 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.653 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -80.92 111.56 17.5 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.5 pt-20 -104.46 131.27 52.03 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.524 0.729 . . . . 0.0 110.222 -175.88 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HD2' HD21 ' A' ' 61' ' ' LEU . 5.6 p90 -148.52 123.86 10.27 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.124 0.57 . . . . 0.0 111.883 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.12 110.84 8.74 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.033 1.333 . . . . 0.0 110.061 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 59' ' ' LEU . 53.7 tp -104.37 129.41 52.29 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -131.93 133.86 45.01 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.546 0.529 . . . . 0.0 111.255 -174.47 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.464 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.5 mtpt -85.11 105.0 15.51 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.953 0.901 . . . . 0.0 109.491 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.1 p -71.92 145.27 48.59 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -63.3 -20.49 65.53 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 124.708 1.255 . . . . 0.0 112.323 -175.469 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . . . -64.77 -15.72 62.03 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.819 0.848 . . . . 0.0 111.767 172.786 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.93 37.94 4.78 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 124.27 0.938 . . . . 0.0 111.95 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 56' ' ' ALA . 43.9 mtmt -127.64 161.44 28.86 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 120.809 0.337 . . . . 0.0 111.417 -173.612 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.565 ' HB3' HD11 ' A' ' 51' ' ' LEU . 48.3 mt -110.34 126.81 54.63 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.187 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -115.93 114.69 25.0 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.747 1.219 . . . . 0.0 108.82 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.568 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.8 tm? -102.36 100.4 10.55 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.5 p -105.73 152.82 22.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.515 1.126 . . . . 0.0 108.922 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 123.13 0.572 . . . . 0.0 109.985 177.857 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -147.43 148.66 31.51 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 166.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -96.61 35.1 1.55 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.4 0.68 . . . . 0.0 109.882 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -95.0 92.23 6.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.823 0.849 . . . . 0.0 110.059 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -80.51 90.63 5.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 121.256 0.55 . . . . 0.0 109.798 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -117.64 157.58 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.158 0.983 . . . . 0.0 109.407 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -48.41 154.65 0.6 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 125.263 1.425 . . . . 0.0 112.813 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.6 m -54.59 -30.6 54.99 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.767 0.827 . . . . 0.0 111.568 170.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -53.52 -41.15 66.07 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.898 0.879 . . . . 0.0 111.683 172.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.65 36.72 2.33 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.837 0.855 . . . . 0.0 110.847 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -51.44 -21.54 2.43 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 114.671 1.359 . . . . 0.0 114.671 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.518 HD13 ' HD2' ' A' ' 53' ' ' LYS . 98.5 mt -123.25 -42.93 2.22 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.29 -157.66 52.59 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.892 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.64 3.69 7.52 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.852 2.368 . . . . 0.0 112.315 173.941 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -99.76 -54.06 3.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.304 1.042 . . . . 0.0 110.239 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 108.31 -11.34 36.63 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.824 -0.625 . . . . 0.0 114.459 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 pptp? -146.69 111.7 5.38 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 117.887 0.844 . . . . 0.0 110.772 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.8 m -147.06 167.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 124.219 1.008 . . . . 0.0 109.908 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.452 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 58.9 mt -90.75 120.85 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 172.544 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -79.77 110.17 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 124.897 1.279 . . . . 0.0 110.376 -177.749 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.93 137.43 34.21 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.673 167.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -160.27 95.69 1.15 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.248 1.019 . . . . 0.0 109.227 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.6 m120 65.06 31.18 11.28 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.3 1.04 . . . . 0.0 111.667 172.252 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.5 -15.16 62.51 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.999 -0.546 . . . . 0.0 113.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -87.61 142.92 27.47 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.8 pt-20 -129.31 137.13 50.84 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -152.41 124.8 8.21 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.487 0.715 . . . . 0.0 110.997 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -70.82 122.9 20.75 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.524 1.13 . . . . 0.0 109.912 -175.086 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.2 tp -113.27 127.2 56.08 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 168.512 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 ptm180 -128.48 135.62 49.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -75.95 99.36 4.51 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 166.627 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -65.17 138.73 58.45 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.39 -5.7 25.25 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 123.889 0.743 . . . . 0.0 111.57 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.22 -14.63 61.11 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.065 0.946 . . . . 0.0 111.492 165.742 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 33.29 6.57 Favored Glycine 0 C--N 1.352 1.452 0 C-N-CA 124.061 0.839 . . . . 0.0 112.024 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -137.9 -175.21 4.01 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.96 0.504 . . . . 0.0 110.703 -173.534 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.1 mt -112.26 159.07 18.98 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.716 1.206 . . . . 0.0 109.774 171.829 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.7 tp -147.11 105.92 3.84 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.177 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.469 HD21 ' HD2' ' A' ' 49' ' ' TYR . 2.4 tm? -99.6 101.21 12.35 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.0 p -120.11 132.68 55.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.055 0.942 . . . . 0.0 110.031 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' HB3' ' A' ' 49' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.284 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 171.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 120.388 0.137 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -170.67 141.87 1.92 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.804 0.69 . . . . 0.0 110.349 178.73 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -94.34 40.33 1.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.343 0.657 . . . . 0.0 110.38 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.463 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.0 tpm_? -91.15 90.69 7.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.067 0.947 . . . . 0.0 109.427 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.66 91.36 5.84 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.463 HG13 ' HG3' ' A' ' 26' ' ' ARG . 22.8 m -107.6 162.87 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.046 0.938 . . . . 0.0 109.172 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -66.13 164.03 16.4 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.859 0.463 . . . . 0.0 111.724 176.607 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 41.7 t -57.72 -28.7 64.11 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.388 1.075 . . . . 0.0 112.924 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -59.34 -32.65 70.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.052 0.541 . . . . 0.0 110.674 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.34 40.36 1.78 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.119 0.968 . . . . 0.0 110.117 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.512 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -46.54 -21.45 0.18 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.534 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -122.43 -33.0 3.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.923 0.489 . . . . 0.0 110.651 174.795 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.51 -152.56 52.36 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.296 -0.724 . . . . 0.0 112.445 -173.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.17 -13.69 12.44 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.667 2.245 . . . . 0.0 112.504 171.309 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -90.22 -43.0 10.7 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.882 0.873 . . . . 0.0 111.506 -170.137 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.474 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 94.58 -16.17 61.74 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.065 -171.913 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.537 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 6.5 ptpp? -130.36 93.28 3.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.736 0.814 . . . . 0.0 110.383 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.8 m -141.66 164.99 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.802 0.841 . . . . 0.0 110.515 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.0 mt -90.17 120.64 39.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.351 0.66 . . . . 0.0 109.243 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.512 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -78.76 132.01 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.032 1.333 . . . . 0.0 109.156 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.17 118.67 34.66 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 172.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' HIS . . . . . 0.492 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 6.1 t-80 -153.43 130.28 10.92 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.726 1.21 . . . . 0.0 110.735 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.63 5.89 88.25 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.414 -0.357 . . . . 0.0 113.064 -172.454 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -94.51 154.69 17.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.827 0.851 . . . . 0.0 109.753 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -123.36 131.59 53.7 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.25 0.62 . . . . 0.0 111.008 -171.876 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HB2' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -144.98 120.89 10.64 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.367 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -80.73 107.19 13.33 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.768 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.461 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.1 tp -103.09 123.62 47.0 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.107 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.452 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 7.9 ptm180 -128.92 133.47 47.88 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.293 -176.265 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -79.02 105.81 10.62 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 172.379 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -70.5 143.64 51.63 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.183 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -73.62 -3.34 27.41 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.867 0.867 . . . . 0.0 112.451 -174.208 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.83 -7.58 56.85 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.905 0.882 . . . . 0.0 110.912 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.29 37.19 5.69 Favored Glycine 0 C--N 1.35 1.32 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.595 177.175 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -129.5 166.69 19.14 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 120.987 0.422 . . . . 0.0 111.576 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.461 ' HB3' HD11 ' A' ' 51' ' ' LEU . 56.3 mt -104.7 127.24 52.4 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.137 0.975 . . . . 0.0 108.907 172.15 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.0 tp -121.0 103.17 8.83 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 49' ' ' TYR . 2.4 tm? -88.3 111.84 22.15 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.491 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.4 p -122.61 137.69 54.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.435 1.094 . . . . 0.0 108.959 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt . . . . . 0 CA--C 1.554 1.099 0 C-N-CA 123.652 0.781 . . . . 0.0 109.015 -175.961 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 120.732 0.301 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.01 142.39 10.29 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.675 1.19 . . . . 0.0 108.061 167.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.471 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 11.0 pt-20 -90.59 31.89 1.01 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.313 0.577 . . . . 0.0 111.115 178.309 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -84.14 94.63 8.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.536 1.134 . . . . 0.0 109.646 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.471 ' NH1' ' HB2' ' A' ' 25' ' ' GLU . 8.8 mpt_? -76.42 105.1 7.28 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.586 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.7 m -121.86 159.66 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.163 0.985 . . . . 0.0 108.906 170.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.51 155.17 33.73 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.066 0.546 . . . . 0.0 109.661 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -55.33 -20.99 13.2 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.85 1.26 . . . . 0.0 113.714 -175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -56.9 -38.79 73.31 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.382 0.673 . . . . 0.0 110.787 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.87 40.79 1.38 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.131 0.972 . . . . 0.0 110.511 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.21 -18.44 0.59 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 124.792 1.237 . . . . 0.0 114.232 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.24 -57.41 1.49 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.737 0.815 . . . . 0.0 109.488 167.92 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.27 -154.24 52.41 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.259 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -75.9 -17.56 17.54 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.435 2.09 . . . . 0.0 111.701 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.99 -41.75 73.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.28 1.032 . . . . 0.0 110.462 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.63 -5.81 49.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.795 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.62 105.3 2.42 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.575 1.15 . . . . 0.0 108.745 -178.214 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.8 m -144.22 169.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' TYR . 55.5 mt -90.07 110.87 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 114.353 -1.294 . . . . 0.0 108.63 169.471 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.516 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.8 132.28 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.208 1.403 . . . . 0.0 109.25 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -105.35 107.68 18.8 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 164.672 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -123.9 96.6 5.01 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -177.785 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 t30 60.61 42.44 13.95 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.59 1.156 . . . . 0.0 109.702 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.64 -18.7 28.48 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.82 -1.082 . . . . 0.0 114.072 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -83.96 118.55 24.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.802 0.841 . . . . 0.0 110.289 -176.096 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -88.56 133.12 34.26 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.799 0.439 . . . . 0.0 110.849 -179.669 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 41' ' ' ILE . 5.5 m-85 -131.14 177.45 7.45 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.78 108.39 9.83 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 59' ' ' LEU . 47.0 tp -104.41 124.19 48.78 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.446 ' HE ' HG22 ' A' ' 54' ' ' THR . 13.0 ptt180 -125.96 136.94 53.59 Favored 'General case' 0 C--O 1.242 0.67 0 O-C-N 123.482 0.488 . . . . 0.0 110.642 -177.539 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -79.15 99.12 6.83 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 168.671 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.446 HG22 ' HE ' ' A' ' 52' ' ' ARG . 35.8 p -68.62 149.06 49.59 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.748 178.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.33 -10.36 59.69 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 124.702 1.251 . . . . 0.0 113.218 -169.73 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.85 -14.34 59.91 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.472 0.709 . . . . 0.0 110.68 170.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.57 43.46 2.31 Favored Glycine 0 C--N 1.352 1.465 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.967 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -134.07 -179.49 5.59 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 116.806 0.303 . . . . 0.0 111.402 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 51' ' ' LEU . 83.5 mt -124.14 129.41 50.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.844 1.258 . . . . 0.0 109.818 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -123.56 105.1 9.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.674 0.79 . . . . 0.0 109.347 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' A' ' 51' ' ' LEU . 3.3 tm? -96.9 100.39 11.92 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.3 p -130.71 135.53 47.9 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.224 1.01 . . . . 0.0 109.617 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 123.94 0.896 . . . . 0.0 109.183 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 121.028 0.442 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.43 161.65 42.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.397 170.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -114.41 22.85 13.32 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.978 0.511 . . . . 0.0 109.987 171.155 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -77.18 88.61 3.64 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -77.14 87.85 3.61 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 121.803 0.811 . . . . 0.0 110.11 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -116.8 159.32 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 114.46 -1.246 . . . . 0.0 109.347 178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -59.37 161.43 5.65 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.913 0.885 . . . . 0.0 112.248 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.9 p -54.41 -30.33 51.92 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.068 0.947 . . . . 0.0 113.377 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -62.65 -30.79 71.63 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.643 0.377 . . . . 0.0 111.728 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.06 34.72 2.93 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.069 0.948 . . . . 0.0 110.661 176.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.421 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -49.48 -17.91 0.35 Allowed 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.529 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -125.58 -41.92 1.98 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.118 0.567 . . . . 0.0 110.089 174.133 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.67 -162.89 44.4 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.174 0.921 . . . . 0.0 112.699 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.5 -15.34 34.32 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.549 2.166 . . . . 0.0 112.274 172.445 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.92 -40.66 46.41 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.06 0.944 . . . . 0.0 111.165 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.51 -6.63 83.09 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.347 -169.583 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.03 122.05 7.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.497 1.119 . . . . 0.0 109.501 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.2 m -152.33 172.45 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.812 0.845 . . . . 0.0 110.248 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.3 mt -93.39 116.75 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 167.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 51' ' ' LEU . 1.4 mp -76.32 123.0 31.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 124.596 1.158 . . . . 0.0 109.302 177.6 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -97.75 122.01 40.33 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -157.94 117.18 3.22 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 123.314 0.646 . . . . 0.0 109.639 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.5 m120 66.88 16.97 10.49 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.78 1.232 . . . . 0.0 111.92 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.39 75.04 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 122.989 0.328 . . . . 0.0 113.069 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -90.46 156.98 17.81 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.751 0.82 . . . . 0.0 110.206 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.23 126.02 38.2 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.742 0.817 . . . . 0.0 109.717 -177.122 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.7 136.79 27.66 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.178 0.591 . . . . 0.0 109.655 177.244 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -84.63 123.98 30.95 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.039 0.935 . . . . 0.0 109.301 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.48 HD11 ' HB3' ' A' ' 59' ' ' LEU . 59.2 tp -119.5 136.8 54.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.599 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -139.76 143.83 37.13 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.499 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.529 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.4 mtpm? -83.02 98.99 9.56 Favored 'General case' 0 C--N 1.347 0.478 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -63.63 139.26 58.75 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -74.0 1.55 10.67 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -175.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.97 -18.79 63.37 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.548 0.739 . . . . 0.0 110.838 164.791 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.63 33.42 4.15 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.903 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.423 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.6 mtpt -134.94 -178.07 4.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.7 0.8 . . . . 0.0 111.253 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.48 ' HB3' HD11 ' A' ' 51' ' ' LEU . 69.8 mt -108.24 166.46 10.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.312 1.045 . . . . 0.0 109.99 169.141 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.4 tp -152.33 106.16 3.11 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.39 101.1 13.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -103.91 164.46 11.68 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.244 1.018 . . . . 0.0 108.991 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.255 1.347 0 CA-C-O 118.631 -0.699 . . . . 0.0 109.435 176.912 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -168.07 140.45 3.03 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.079 0.952 . . . . 0.0 109.448 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.36 24.91 4.71 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.619 0.723 . . . . 0.0 109.526 169.519 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -70.55 78.62 0.58 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.706 1.602 . . . . 0.0 110.143 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -81.36 91.07 6.21 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.755 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 m -122.76 154.13 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.64 1.176 . . . . 0.0 109.565 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -60.33 155.52 17.72 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.558 0.743 . . . . 0.0 111.111 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.443 ' HA ' HG23 ' A' ' 42' ' ' ILE . 48.3 p -51.44 -25.19 5.91 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.031 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -66.66 -25.71 66.7 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.422 0.63 . . . . 0.0 111.306 177.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.53 32.99 4.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.709 1.204 . . . . 0.0 110.469 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -50.03 -18.32 0.53 Allowed 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 124.593 1.157 . . . . 0.0 114.09 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.476 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.1 mt -126.4 -49.55 1.54 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.64 0.776 . . . . 0.0 109.715 170.535 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.08 -152.96 46.03 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-N 115.563 -0.744 . . . . 0.0 113.589 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.43 -17.0 21.47 Favored 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 122.682 2.255 . . . . 0.0 112.296 173.795 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -76.73 -38.78 53.66 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.192 0.997 . . . . 0.0 110.222 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.59 -0.24 70.97 Favored Glycine 0 C--N 1.347 1.178 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.953 -171.808 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.8 106.24 1.08 Allowed 'General case' 0 C--N 1.351 0.673 0 C-N-CA 124.427 1.091 . . . . 0.0 108.861 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.9 m -138.73 169.66 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.919 0.888 . . . . 0.0 110.034 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -91.76 109.02 20.72 Favored 'Isoleucine or valine' 0 C--O 1.243 0.756 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 164.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.443 HG23 ' HA ' ' A' ' 30' ' ' SER . 54.4 mt -61.12 132.41 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.033 0.933 . . . . 0.0 109.694 174.344 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -116.73 120.8 39.71 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 174.317 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -160.85 118.26 2.39 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.487 0.315 . . . . 0.0 111.269 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 t30 55.65 51.1 13.1 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.178 1.391 . . . . 0.0 111.68 171.23 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.43 -18.89 12.29 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.317 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -105.39 144.08 32.67 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.52 0.728 . . . . 0.0 110.232 -173.674 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.422 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.0 pt-20 -134.43 138.42 44.78 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.922 0.489 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -151.56 136.2 17.06 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.121 0.968 . . . . 0.0 110.236 -172.444 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.82 113.31 13.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.707 0.803 . . . . 0.0 109.957 -178.376 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.406 HD22 HD11 ' A' ' 42' ' ' ILE . 56.9 tp -104.29 138.8 40.21 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 169.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -141.29 146.66 37.06 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 111.058 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.4 mtpm? -78.64 107.64 11.46 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 167.294 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.7 p -67.33 130.07 41.89 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.734 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.44 -20.07 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 123.852 0.72 . . . . 0.0 111.148 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.44 -24.57 63.64 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.994 0.918 . . . . 0.0 111.187 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.03 43.03 0.88 Allowed Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.492 173.244 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -144.62 -174.39 4.31 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.102 0.561 . . . . 0.0 110.486 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.8 mt -116.07 142.93 46.15 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.669 1.188 . . . . 0.0 108.739 169.706 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -126.74 107.23 9.97 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -90.89 125.92 35.9 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 173.327 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -141.39 167.74 21.43 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.154 1.382 . . . . 0.0 108.491 -176.991 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? . . . . . 0 C--O 1.25 1.09 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 172.136 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.08 0.467 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.59 173.54 14.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.879 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.34 38.57 1.55 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 122.012 0.91 . . . . 0.0 109.454 172.295 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.0 ttt180 -82.33 95.75 7.71 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.939 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.78 95.01 3.94 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 m -131.36 158.2 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.03 0.932 . . . . 0.0 109.342 175.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.09 158.58 16.34 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.134 0.897 . . . . 0.0 110.913 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.5 t -54.12 -22.39 10.97 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.713 1.205 . . . . 0.0 113.813 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -58.39 -38.87 78.22 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.099 0.56 . . . . 0.0 110.915 175.538 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.03 36.37 2.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.981 0.913 . . . . 0.0 110.596 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.03 -24.12 6.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 124.553 1.141 . . . . 0.0 113.948 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -130.33 -69.52 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.107 0.563 . . . . 0.0 109.653 174.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.26 -161.6 50.15 Favored Glycine 0 CA--C 1.533 1.179 0 O-C-N 123.996 0.81 . . . . 0.0 112.071 -172.478 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.93 -11.83 31.39 Favored 'Trans proline' 0 C--N 1.37 1.706 0 C-N-CA 122.759 2.306 . . . . 0.0 112.448 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.39 -49.95 61.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.146 0.978 . . . . 0.0 109.662 174.818 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.47 3.58 78.15 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.877 -1.056 . . . . 0.0 113.36 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -161.62 110.46 1.52 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.239 1.016 . . . . 0.0 108.29 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 m -147.08 167.53 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 123.013 0.525 . . . . 0.0 110.334 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.1 mt -90.54 108.03 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 166.811 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.32 135.25 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.634 1.174 . . . . 0.0 109.41 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -115.69 127.06 54.88 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 124.521 1.128 . . . . 0.0 108.472 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -165.79 123.37 1.48 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.846 0.858 . . . . 0.0 109.688 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 67.3 26.77 8.46 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.588 1.155 . . . . 0.0 110.725 173.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.84 16.24 79.38 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.121 -176.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -114.96 133.67 55.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.061 0.944 . . . . 0.0 108.833 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -116.55 133.22 56.27 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.122 0.969 . . . . 0.0 110.541 -174.031 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -140.7 125.26 17.86 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -79.64 106.05 11.39 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.417 ' HB3' HD11 ' A' ' 42' ' ' ILE . 59.9 tp -101.99 131.36 48.45 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -138.4 140.34 39.31 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 123.836 0.71 . . . . 0.0 110.306 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -84.63 112.16 20.2 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 173.55 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 9.6 p -74.53 148.22 41.09 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.72 -8.61 44.34 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 124.17 0.919 . . . . 0.0 112.692 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.9 -3.83 37.54 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.591 0.757 . . . . 0.0 111.505 169.748 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.89 38.91 7.75 Favored Glycine 0 C--N 1.353 1.504 0 C-N-CA 123.355 0.503 . . . . 0.0 112.12 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 22.8 mtpp -130.97 -178.48 4.84 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.155 0.582 . . . . 0.0 110.675 -174.12 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.7 mt -111.3 156.24 21.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.46 1.104 . . . . 0.0 109.39 169.281 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.3 tp -144.76 101.57 3.67 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 176.098 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -84.56 114.73 22.18 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 174.462 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.7 p -126.45 154.79 43.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.502 1.121 . . . . 0.0 108.565 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.921 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.01 117.54 1.21 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 123.848 0.717 . . . . 0.0 109.637 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.58 69.58 7.11 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.807 0.843 . . . . 0.0 109.196 173.597 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -125.67 88.73 2.91 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.594 0.758 . . . . 0.0 109.114 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.1 mtp85 -81.33 90.39 6.14 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.523 0.678 . . . . 0.0 110.375 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.5 m -121.34 157.73 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.758 1.223 . . . . 0.0 109.173 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -64.62 156.93 28.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.569 0.747 . . . . 0.0 110.148 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.8 t -56.41 -20.16 18.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.362 1.065 . . . . 0.0 113.787 -174.553 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -54.88 -40.85 70.18 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.771 0.828 . . . . 0.0 111.372 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.78 40.31 1.4 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.491 1.116 . . . . 0.0 110.347 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -48.08 -18.53 0.2 Allowed 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.57 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 86.0 mt -117.25 -33.49 4.64 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.538 0.608 . . . . 0.0 110.963 176.748 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.66 -145.61 45.68 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-O 118.939 -0.923 . . . . 0.0 112.465 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -88.1 -13.41 3.75 Favored 'Trans proline' 0 C--N 1.369 1.64 0 C-N-CA 122.98 2.453 . . . . 0.0 112.92 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -91.72 -29.15 16.98 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.591 0.757 . . . . 0.0 111.538 -173.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.57 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 86.11 0.67 86.99 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -165.101 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -146.46 119.74 8.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.729 1.212 . . . . 0.0 109.197 -176.154 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.437 HG23 HD12 ' A' ' 42' ' ' ILE . 35.7 m -151.1 171.6 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.137 0.975 . . . . 0.0 109.601 178.135 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 62.1 mt -91.35 106.54 17.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 168.805 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.437 HD12 HG23 ' A' ' 40' ' ' VAL . 1.6 mp -68.48 137.08 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 124.726 1.21 . . . . 0.0 109.926 176.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -112.4 126.57 55.43 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 169.882 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -164.47 140.68 6.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 173.731 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 66.55 14.76 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.097 1.359 . . . . 0.0 111.442 -175.688 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.29 -5.38 72.84 Favored Glycine 0 C--N 1.352 1.459 0 C-N-CA 123.329 0.49 . . . . 0.0 112.8 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -95.76 161.46 14.01 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.408 1.083 . . . . 0.0 109.782 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.45 138.52 54.01 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.333 0.653 . . . . 0.0 110.14 -178.011 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 140.21 26.16 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.04 122.72 30.46 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -114.07 135.1 54.39 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 167.222 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -138.86 137.8 36.88 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.505 0.503 . . . . 0.0 111.094 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.562 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -79.01 102.38 8.31 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 169.951 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.3 p -65.74 140.28 58.43 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -75.44 -0.59 20.57 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.126 0.489 . . . . 0.0 111.676 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.93 -1.51 22.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.895 0.878 . . . . 0.0 111.236 163.804 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.32 35.57 8.68 Favored Glycine 0 C--N 1.35 1.356 0 C-N-CA 124.018 0.818 . . . . 0.0 112.571 174.337 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -133.96 173.85 11.12 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.667 0.387 . . . . 0.0 111.362 -174.413 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.473 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.6 mt -110.15 136.18 49.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.939 1.295 . . . . 0.0 109.274 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.33 98.7 5.55 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -92.8 104.67 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -115.28 126.78 54.91 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.613 1.165 . . . . 0.0 108.88 175.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.909 -175.972 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.596 ' HB3' HD11 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.09 163.97 28.34 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.208 0.603 . . . . 0.0 110.735 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.02 24.58 8.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 110.13 172.276 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -81.28 93.71 6.59 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.919 0.487 . . . . 0.0 110.874 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 102.46 4.43 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.3 m -123.32 157.61 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.705 1.202 . . . . 0.0 108.136 168.999 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 7.1 p30 -74.03 167.05 22.3 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 122.941 0.151 . . . . 0.0 110.675 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -48.56 -30.94 5.81 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -172.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -62.81 -31.86 72.93 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 118.503 0.592 . . . . 0.0 111.197 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.86 30.07 5.39 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.391 1.077 . . . . 0.0 110.202 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.6 pt? -48.94 -29.33 4.64 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.523 1.129 . . . . 0.0 113.833 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 93.3 mt -130.97 -69.92 0.62 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 109.735 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.9 -151.66 52.12 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.932 -174.0 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.27 -13.66 25.59 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 122.523 2.148 . . . . 0.0 112.437 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.7 -60.49 2.21 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.167 0.987 . . . . 0.0 110.397 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.72 -17.33 45.73 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-N 114.822 -1.081 . . . . 0.0 113.178 -175.937 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -136.45 99.38 4.07 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.654 0.782 . . . . 0.0 110.108 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.69 165.3 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 124.02 0.928 . . . . 0.0 109.468 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.416 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 54.6 mt -90.19 118.54 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.257 0.623 . . . . 0.0 109.666 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 mp -78.56 131.09 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.972 1.309 . . . . 0.0 110.009 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.5 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 12.2 t70 -104.13 122.29 45.01 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 124.894 1.277 . . . . 0.0 107.781 171.35 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -156.98 110.53 2.61 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.31 0.644 . . . . 0.0 109.366 -175.46 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.4 m120 61.65 28.25 17.46 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.155 0.982 . . . . 0.0 111.375 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.54 -9.35 76.15 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.862 -0.608 . . . . 0.0 113.464 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -81.18 138.38 35.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.445 0.698 . . . . 0.0 109.972 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.45 124.75 52.91 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.879 0.871 . . . . 0.0 108.69 177.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.479 ' HD2' HD21 ' A' ' 61' ' ' LEU . 8.7 p90 -152.6 125.07 8.23 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.81 0.444 . . . . 0.0 112.054 177.952 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.596 HD11 ' HB3' ' A' ' 23' ' ' ALA . 3.2 tm? -77.93 115.54 17.74 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.611 1.165 . . . . 0.0 109.455 -173.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.441 HD11 ' HB3' ' A' ' 59' ' ' LEU . 36.0 tp -104.56 131.17 52.28 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 171.893 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' ' 60' ' ' LEU . 15.7 ptm180 -134.52 134.31 41.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.043 0.839 . . . . 0.0 110.688 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.458 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.8 mtpm? -82.74 103.9 12.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.481 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.2 p -64.93 144.01 57.57 Favored 'General case' 0 C--O 1.253 1.254 0 O-C-N 123.968 0.793 . . . . 0.0 109.362 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -68.87 -11.63 60.73 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.358 1.063 . . . . 0.0 112.146 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.93 -0.87 17.47 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.933 0.893 . . . . 0.0 111.431 169.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.96 44.53 7.62 Favored Glycine 0 C--N 1.354 1.53 0 C-N-CA 123.585 0.612 . . . . 0.0 112.2 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -139.39 174.97 9.97 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 122.555 0.342 . . . . 0.0 110.748 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' HB3' HD11 ' A' ' 51' ' ' LEU . 80.9 mt -109.14 135.27 50.55 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.351 1.061 . . . . 0.0 109.957 171.919 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' HD3' ' A' ' 52' ' ' ARG . 14.6 tp -125.0 106.34 9.88 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LEU . . . . . 0.479 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.4 tm? -89.13 100.95 13.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 67.3 p -108.91 159.76 16.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 C--O 1.252 1.191 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.981 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -153.2 143.25 22.24 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.208 -1.36 . . . . 0.0 109.262 172.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -86.3 30.96 0.67 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.467 0.707 . . . . 0.0 111.571 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.461 ' HG3' HG13 ' A' ' 28' ' ' VAL . 7.8 tpp180 -87.96 92.87 9.29 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.097 0.559 . . . . 0.0 109.616 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -79.72 103.76 9.84 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.189 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.461 HG13 ' HG3' ' A' ' 26' ' ' ARG . 20.8 m -110.88 154.1 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.617 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -52.44 150.13 5.13 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.481 0.712 . . . . 0.0 111.02 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' SER . . . . . 0.539 ' HA ' HG23 ' A' ' 42' ' ' ILE . 15.5 m -47.24 -35.17 7.32 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -58.09 -32.32 67.96 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.902 0.881 . . . . 0.0 112.202 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.66 31.23 4.86 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.284 1.034 . . . . 0.0 111.75 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -46.2 -22.83 0.27 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -178.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -125.31 -68.9 0.81 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.472 0.709 . . . . 0.0 109.923 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.78 -153.59 51.54 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 113.457 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -70.5 -16.65 34.46 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.983 2.456 . . . . 0.0 112.247 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.56 -56.64 3.75 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.834 0.854 . . . . 0.0 110.167 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.9 -10.01 64.12 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-N 114.799 -1.091 . . . . 0.0 113.397 -175.538 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -136.41 73.53 1.46 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.198 0.999 . . . . 0.0 110.708 -175.826 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 19.6 m -135.88 161.15 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.008 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 35.1 mt -86.83 121.79 38.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.08 -178.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 51' ' ' LEU . 48.8 mt -69.6 105.9 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.798 0.839 . . . . 0.0 109.39 173.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -87.16 121.52 29.73 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 172.653 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -147.46 95.71 2.58 Favored 'General case' 0 C--O 1.241 0.658 0 O-C-N 123.869 0.731 . . . . 0.0 110.035 -175.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 23.6 m120 58.42 45.15 17.13 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.422 1.089 . . . . 0.0 112.034 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.84 -26.41 6.02 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 113.709 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.71 107.7 15.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -101.42 138.56 38.27 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.641 0.776 . . . . 0.0 109.675 178.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.605 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -147.69 126.43 12.61 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.544 0.737 . . . . 0.0 109.035 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 2.9 tm? -71.71 126.14 28.94 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.115 0.566 . . . . 0.0 110.382 -174.458 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.0 tp -117.15 119.74 36.15 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 172.093 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.9 ptm180 -126.6 136.27 52.31 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.944 0.402 . . . . 0.0 110.616 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -76.36 99.6 4.88 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.5 p -64.39 138.2 58.29 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -72.38 -7.11 47.95 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 124.764 1.29 . . . . 0.0 111.341 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.76 -18.76 62.76 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.888 0.875 . . . . 0.0 111.088 168.28 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.89 38.33 2.2 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.984 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -140.78 176.75 8.54 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.305 0.574 . . . . 0.0 111.428 -174.727 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.1 mt -108.15 136.58 47.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 109.133 169.543 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -119.34 103.69 9.71 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -91.42 124.75 35.84 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.6 p -136.72 120.54 17.43 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.1 0.96 . . . . 0.0 108.981 -174.385 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HD3' ' HB3' ' A' ' 49' ' ' TYR . 35.1 mmtp . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.021 0.928 . . . . 0.0 109.819 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -166.01 114.67 0.95 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.12 0.568 . . . . 0.0 110.76 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.17 100.23 4.22 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-O 121.992 0.901 . . . . 0.0 109.442 175.043 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -150.61 91.22 1.71 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 108.865 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.74 86.78 3.36 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.447 -176.297 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.8 m -101.33 167.58 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.451 1.1 . . . . 0.0 108.048 172.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -55.01 149.22 12.19 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.589 0.756 . . . . 0.0 111.343 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 t -58.71 -26.12 63.59 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.33 0.652 . . . . 0.0 111.609 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -60.49 -35.72 76.61 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.757 0.823 . . . . 0.0 110.983 172.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.54 30.54 3.54 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.193 0.997 . . . . 0.0 110.972 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -47.03 -28.44 1.68 Allowed 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.918 1.287 . . . . 0.0 114.324 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 88.7 mt -121.37 -56.12 1.91 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.499 0.72 . . . . 0.0 109.376 175.419 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.25 -151.75 50.23 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.333 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.86 -13.13 14.51 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.535 2.157 . . . . 0.0 112.496 172.681 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.58 -43.44 15.67 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.672 0.789 . . . . 0.0 110.488 -177.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 79.0 4.32 88.66 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.449 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 17.3 ptpt -151.59 75.23 1.16 Allowed 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.756 0.789 . . . . 0.0 110.387 -173.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -141.46 169.6 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.124 -175.331 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 48' ' ' GLU . 23.0 mt -91.59 125.08 44.32 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 CA-C-O 121.499 0.666 . . . . 0.0 110.9 -178.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -62.96 134.8 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.839 1.656 . . . . 0.0 109.464 168.57 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -114.72 115.52 27.21 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 163.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -126.73 87.23 2.62 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.1 t30 66.66 22.43 10.44 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 124.617 1.167 . . . . 0.0 110.766 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.57 -4.99 56.79 Favored Glycine 0 C--N 1.351 1.416 0 O-C-N 121.772 -0.58 . . . . 0.0 113.333 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -81.55 108.08 14.83 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.597 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 9.8 pt-20 -98.25 135.21 40.21 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.477 0.486 . . . . 0.0 111.303 -174.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -145.71 125.9 13.82 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 123.555 0.742 . . . . 0.0 110.021 175.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -78.91 103.18 8.68 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.565 0.62 . . . . 0.0 109.55 176.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.0 tp -96.72 132.33 42.51 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 17.1 ptm180 -138.7 137.75 37.09 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 123.54 0.525 . . . . 0.0 111.214 -175.247 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -81.47 99.23 8.64 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.431 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 17.1 p -67.7 142.47 56.31 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 123.899 0.749 . . . . 0.0 109.412 -177.875 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -64.01 -16.35 61.43 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 124.877 1.361 . . . . 0.0 112.004 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.08 -7.63 31.06 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.174 0.99 . . . . 0.0 112.459 171.452 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.02 42.66 5.9 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.687 0.661 . . . . 0.0 112.007 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.8 mtpt -140.98 177.84 7.78 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.092 0.557 . . . . 0.0 110.479 -172.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.2 mt -114.24 143.61 44.57 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.646 1.178 . . . . 0.0 109.198 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.537 ' HG ' HG23 ' A' ' 62' ' ' THR . 17.9 tp -132.98 105.32 7.01 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.692 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -89.61 102.11 14.79 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' THR . . . . . 0.537 HG23 ' HG ' ' A' ' 60' ' ' LEU . 25.6 p -129.14 123.13 31.34 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.9 0.88 . . . . 0.0 109.913 -175.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 48' ' ' GLU . 24.1 tptp . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.44 118.15 1.91 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.72 1.208 . . . . 0.0 108.518 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -71.05 90.39 0.84 Allowed 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.149 0.58 . . . . 0.0 109.587 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -139.01 84.2 2.0 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.09 0.956 . . . . 0.0 108.883 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -75.94 86.18 2.87 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.341 0.591 . . . . 0.0 110.24 -177.664 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -109.93 149.11 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 124.468 1.107 . . . . 0.0 108.216 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -51.83 157.87 1.12 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.591 1.156 . . . . 0.0 112.702 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -54.05 -28.05 36.27 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.209 1.004 . . . . 0.0 113.301 179.491 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -62.12 -34.98 77.36 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.999 0.428 . . . . 0.0 110.654 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.4 35.59 2.08 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.589 1.156 . . . . 0.0 110.695 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -47.71 -21.53 0.39 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.9 mt -130.49 -43.3 1.14 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.256 0.623 . . . . 0.0 109.917 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.63 -158.6 51.21 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.62 -175.667 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.95 -14.47 15.33 Favored 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 169.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -79.2 -35.42 41.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.878 0.871 . . . . 0.0 111.077 -174.892 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.0 -11.13 63.35 Favored Glycine 0 C--N 1.352 1.453 0 N-CA-C 114.665 0.626 . . . . 0.0 114.665 171.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -149.58 85.9 1.45 Allowed 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.054 0.927 . . . . 0.0 110.183 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -131.58 171.32 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.393 0.677 . . . . 0.0 110.462 -171.512 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.421 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 32.9 mt -99.91 123.22 52.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 123.183 0.593 . . . . 0.0 109.805 176.868 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -73.55 122.7 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 124.896 1.279 . . . . 0.0 109.011 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -93.59 123.03 36.64 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.279 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -148.63 96.71 2.63 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.706 0.802 . . . . 0.0 109.959 -177.449 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 59.15 30.94 20.83 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.576 1.151 . . . . 0.0 112.15 172.074 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.11 -22.3 39.89 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-O 119.698 -0.501 . . . . 0.0 113.397 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -83.6 153.53 24.26 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.8 pt-20 -133.92 135.3 43.5 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.166 0.291 . . . . 0.0 110.617 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -135.52 113.9 11.56 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -70.21 110.59 5.29 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 175.305 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.403 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.4 tp -106.56 118.62 37.13 Favored 'General case' 0 C--O 1.249 1.041 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.485 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.6 ptm180 -123.6 137.05 54.82 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.979 0.512 . . . . 0.0 110.76 -177.794 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -78.47 99.32 6.39 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -69.58 142.84 53.48 Favored 'General case' 0 C--O 1.251 1.174 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -69.44 -10.3 57.39 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.105 0.962 . . . . 0.0 111.602 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.61 -24.41 67.56 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.572 0.749 . . . . 0.0 110.948 167.08 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.94 37.53 2.71 Favored Glycine 0 C--N 1.35 1.307 0 C-N-CA 124.358 0.98 . . . . 0.0 111.733 -179.559 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.9 mtpt -135.02 176.04 9.03 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.444 0.64 . . . . 0.0 111.524 -172.641 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.403 ' HB3' HD11 ' A' ' 51' ' ' LEU . 49.8 mt -109.58 141.71 41.69 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.035 -1.438 . . . . 0.0 107.405 163.248 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 tp -131.5 103.08 6.21 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -88.54 113.19 23.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 p -137.63 142.03 41.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.534 1.134 . . . . 0.0 108.884 -175.485 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 122.972 0.509 . . . . 0.0 109.653 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.99 161.1 41.48 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.402 1.081 . . . . 0.0 108.933 171.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -111.07 29.59 7.65 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.894 0.854 . . . . 0.0 109.238 168.886 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -82.25 86.23 6.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.778 0.831 . . . . 0.0 109.947 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -77.15 87.5 3.61 Favored 'General case' 0 C--N 1.36 1.023 0 CA-C-O 121.091 0.472 . . . . 0.0 110.185 177.949 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.5 m -101.86 154.35 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 173.501 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -58.6 150.55 22.78 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.097 0.559 . . . . 0.0 109.764 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 p -51.04 -25.05 4.33 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -175.698 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -56.29 -38.73 71.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.82 0.848 . . . . 0.0 111.506 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.37 36.29 2.19 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.969 0.908 . . . . 0.0 110.777 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -46.39 -26.26 0.8 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.558 1.543 . . . . 0.0 115.029 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 97.5 mt -127.38 -54.34 1.36 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 122.824 0.45 . . . . 0.0 110.089 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 -158.46 53.39 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.488 -175.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -78.21 -7.55 16.16 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.372 2.048 . . . . 0.0 112.031 172.47 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.92 -48.35 13.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.459 1.104 . . . . 0.0 110.467 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.22 -12.9 61.16 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.898 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -142.9 89.46 2.12 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 117.579 0.69 . . . . 0.0 110.761 -177.791 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.3 m -140.56 163.01 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 123.213 0.605 . . . . 0.0 110.363 -175.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 25.7 mt -88.49 125.41 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -81.15 119.57 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.246 1.419 . . . . 0.0 109.329 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -103.19 115.4 30.5 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.059 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -161.99 142.07 10.15 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.158 0.983 . . . . 0.0 108.729 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.5 m120 70.18 12.61 7.69 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.554 1.542 . . . . 0.0 111.611 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.0 83.09 Favored Glycine 0 C--N 1.345 1.034 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 -170.738 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -111.15 158.05 19.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.348 1.059 . . . . 0.0 108.683 178.064 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.74 125.86 27.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 122.811 0.444 . . . . 0.0 110.435 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -148.5 126.78 12.21 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 111.273 -174.199 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.527 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 3.3 tm? -75.29 122.74 24.17 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.855 1.262 . . . . 0.0 110.722 -172.602 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' A' ' 59' ' ' LEU . 54.9 tp -111.29 127.04 55.5 Favored 'General case' 0 C--O 1.245 0.866 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 167.952 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.448 ' HD3' HD23 ' A' ' 60' ' ' LEU . 16.9 ptm180 -128.24 142.93 51.02 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.71 0.631 . . . . 0.0 110.564 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.42 ' HD2' HD13 ' A' ' 34' ' ' LEU . 27.5 mtpp -83.59 104.88 14.07 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.717 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.2 p -71.4 134.23 46.5 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 172.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -72.98 -0.64 14.33 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.964 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.15 -14.21 61.76 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.953 0.901 . . . . 0.0 110.715 166.891 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.82 35.15 4.11 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.501 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -139.42 173.52 11.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.006 0.523 . . . . 0.0 111.289 -174.376 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 51' ' ' LEU . 59.7 mt -111.26 144.42 40.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.301 1.04 . . . . 0.0 109.242 174.725 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LEU . . . . . 0.448 HD23 ' HD3' ' A' ' 52' ' ' ARG . 16.3 tp -132.47 113.83 13.58 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -177.263 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.76 124.52 35.95 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.485 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 80.9 p -142.39 -169.59 3.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.155 1.782 . . . . 0.0 106.534 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HA ' ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 121.548 -0.72 . . . . 0.0 110.577 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB1' ' HD3' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 39' ' ' LYS . . . -164.58 118.8 1.37 Allowed 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.748 0.819 . . . . 0.0 109.606 172.262 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -77.83 85.52 4.1 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 122.036 0.922 . . . . 0.0 109.789 177.246 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.401 ' HG3' HG13 ' A' ' 28' ' ' VAL . 19.7 tpp180 -137.47 90.08 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.719 -178.526 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -74.85 89.66 2.35 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.529 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.401 HG13 ' HG3' ' A' ' 26' ' ' ARG . 23.5 m -112.61 161.11 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.006 1.323 . . . . 0.0 109.214 172.699 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.439 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 58.5 t30 -69.66 160.62 31.25 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.401 0.68 . . . . 0.0 109.972 175.351 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.5 m -50.04 -27.56 5.74 Favored 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 124.45 1.1 . . . . 0.0 113.89 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -57.27 -34.59 68.81 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.59 0.756 . . . . 0.0 111.694 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.59 40.83 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.106 0.962 . . . . 0.0 110.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -50.56 -20.25 1.12 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -132.21 -54.2 0.97 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.301 0.64 . . . . 0.0 109.317 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.79 -144.46 45.28 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.974 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -79.85 -12.48 13.43 Favored 'Trans proline' 0 C--N 1.376 2.016 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.95 -42.9 13.65 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.572 -174.992 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.69 3.07 86.8 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.697 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HD3' ' HB1' ' A' ' 23' ' ' ALA . 8.4 ptpp? -160.58 109.82 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.2 m -148.57 174.92 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 123.701 0.8 . . . . 0.0 111.011 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ILE . . . . . 0.404 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 58.8 mt -98.63 108.95 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 C-N-CA 124.127 0.971 . . . . 0.0 109.306 172.24 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -71.72 135.39 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.142 1.377 . . . . 0.0 110.427 176.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.439 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 15.8 t70 -103.71 120.77 41.6 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 169.889 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -160.42 115.38 2.25 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 123.956 0.785 . . . . 0.0 110.004 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 m120 61.88 28.31 17.28 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.805 1.242 . . . . 0.0 111.838 -178.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.49 -7.69 56.78 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.564 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -93.13 137.89 32.06 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.903 0.881 . . . . 0.0 108.646 -177.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 16.2 pt-20 -108.72 129.92 55.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.137 0.575 . . . . 0.0 109.933 -178.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -127.07 125.54 41.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.975 0.51 . . . . 0.0 109.658 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.95 100.71 5.68 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -98.75 124.86 43.87 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -131.24 140.17 49.79 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.103 0.561 . . . . 0.0 110.261 -177.776 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -76.68 112.44 13.25 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 166.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 10.4 p -70.32 146.39 50.57 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -67.63 -9.46 43.29 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.435 1.094 . . . . 0.0 111.679 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.97 5.27 16.82 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.218 1.007 . . . . 0.0 111.448 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.53 40.46 15.36 Favored Glycine 0 C--N 1.353 1.492 0 C-N-CA 123.431 0.539 . . . . 0.0 112.702 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.0 mtpt -133.75 -171.4 2.71 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 122.816 0.446 . . . . 0.0 110.401 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 mt -114.88 163.91 14.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.943 0.897 . . . . 0.0 109.96 168.909 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.8 tp -152.18 103.05 2.83 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.0 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -90.96 102.15 14.92 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 178.915 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 74.4 p -118.04 153.72 33.23 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.339 0.655 . . . . 0.0 109.793 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 120.336 0.112 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.11 148.03 9.82 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.69 0.796 . . . . 0.0 110.375 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' GLU . . . . . 0.458 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 48.7 mt-10 -113.8 35.53 4.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.716 0.806 . . . . 0.0 109.702 174.358 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HG3' HG13 ' A' ' 28' ' ' VAL . 14.3 tpt180 -82.82 85.39 7.1 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.539 178.058 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' ARG . . . . . 0.458 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 6.5 mpt_? -74.28 94.67 2.53 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.135 0.493 . . . . 0.0 109.855 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' VAL . . . . . 0.447 HG13 ' HG3' ' A' ' 26' ' ' ARG . 34.6 m -107.81 172.3 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.863 1.265 . . . . 0.0 108.377 171.459 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.429 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 5.0 m-20 -69.15 165.35 20.59 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.94 0.496 . . . . 0.0 111.497 176.522 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -59.24 -32.4 69.94 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.939 0.895 . . . . 0.0 110.991 168.959 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -55.94 -33.88 65.14 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.059 173.764 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.95 35.08 3.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.125 0.97 . . . . 0.0 111.046 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -46.78 -20.18 0.12 Allowed 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.475 HD22 ' HG3' ' A' ' 53' ' ' LYS . 95.2 mt -130.89 -56.65 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.299 0.64 . . . . 0.0 109.761 172.993 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.83 -158.05 53.07 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.037 -177.23 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -76.76 -10.31 18.4 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.873 2.382 . . . . 0.0 112.274 173.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -75.0 -51.87 12.53 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.787 0.835 . . . . 0.0 109.5 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.69 0.1 88.86 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.851 -176.199 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -154.14 98.05 2.11 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.9 m -143.29 166.62 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 122.945 0.498 . . . . 0.0 110.929 -173.625 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.7 mt -98.31 117.7 43.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.136 168.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -67.79 133.47 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 125.854 1.662 . . . . 0.0 110.112 174.746 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' ASP . . . . . 0.429 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 19.2 t70 -104.25 113.3 26.76 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -155.15 113.8 3.54 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.397 0.436 . . . . 0.0 111.092 -175.421 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.67 36.98 22.54 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.414 1.486 . . . . 0.0 110.646 172.615 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.64 -25.01 12.07 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.442 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -91.99 156.79 17.19 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.949 0.5 . . . . 0.0 110.03 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLU . . . . . 0.511 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -134.5 129.73 35.6 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.337 -174.836 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -134.19 133.29 40.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 122.4 -0.187 . . . . 0.0 110.508 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.61 110.98 12.88 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 59' ' ' LEU . 60.9 tp -108.07 127.12 53.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 170.173 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.94 144.73 51.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.093 0.473 . . . . 0.0 110.342 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.3 mtpt -83.75 98.53 9.74 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 169.839 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.6 p -63.78 139.64 58.79 Favored 'General case' 0 C--O 1.246 0.901 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -64.92 -12.66 51.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.431 1.082 . . . . 0.0 112.331 -176.092 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.64 -13.36 62.3 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.52 0.728 . . . . 0.0 111.569 171.207 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.02 37.74 4.56 Favored Glycine 0 C--N 1.349 1.288 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.153 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -132.36 165.25 24.65 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.669 0.388 . . . . 0.0 110.402 -175.157 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HB3' HD11 ' A' ' 51' ' ' LEU . 76.1 mt -100.97 142.3 32.64 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.725 0.81 . . . . 0.0 109.158 167.532 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.4 tp -130.97 104.18 6.97 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.079 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -93.29 101.59 13.84 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.5 p -115.91 152.44 33.44 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.563 1.145 . . . . 0.0 109.355 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.422 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.785 0.834 . . . . 0.0 108.802 -177.539 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.58 128.91 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.107 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -86.24 79.46 9.07 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.739 0.816 . . . . 0.0 109.94 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -142.42 96.15 2.9 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.93 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.7 mtm105 -85.32 96.95 9.69 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.212 0.53 . . . . 0.0 109.937 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -112.8 168.6 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.375 1.07 . . . . 0.0 108.899 171.662 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -57.26 159.51 4.52 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.512 0.725 . . . . 0.0 111.758 177.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.9 p -56.85 -27.39 60.26 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.901 0.88 . . . . 0.0 111.544 168.898 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.94 -37.3 76.4 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.863 0.865 . . . . 0.0 110.884 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -106.26 37.09 2.37 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.666 0.786 . . . . 0.0 110.869 174.672 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.524 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -49.55 -20.29 0.73 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' LEU . . . . . 0.531 HD13 ' HD2' ' A' ' 53' ' ' LYS . 94.6 mt -126.22 -42.6 1.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.13 0.572 . . . . 0.0 110.299 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.66 -158.9 43.18 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.993 -176.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -79.07 -4.99 14.27 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.641 2.227 . . . . 0.0 112.189 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.89 -33.52 19.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.582 1.153 . . . . 0.0 110.876 -178.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.65 -4.32 60.83 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.81 -173.356 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.24 105.07 2.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.692 0.797 . . . . 0.0 110.357 -175.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.9 m -148.55 171.54 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.663 0.785 . . . . 0.0 110.05 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.0 mt -89.5 119.35 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 123.247 0.619 . . . . 0.0 109.799 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.69 137.62 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.498 1.519 . . . . 0.0 109.263 172.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -126.01 122.39 35.74 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 170.852 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -158.0 110.56 2.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.783 0.433 . . . . 0.0 111.101 -177.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.7 t30 59.37 30.94 20.71 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 125.015 1.326 . . . . 0.0 111.6 173.256 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -18.98 56.49 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.675 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -91.25 128.6 37.13 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.8 135.47 52.97 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.476 0.71 . . . . 0.0 109.97 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -139.01 164.43 29.78 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -103.63 126.62 50.89 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.237 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.3 tp -120.36 122.1 40.05 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 170.73 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -122.12 138.6 54.4 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.638 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -82.72 117.3 22.55 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 171.583 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.496 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 23.6 p -74.87 147.65 40.88 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -67.14 -12.99 61.51 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.6 -6.54 31.83 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.884 0.874 . . . . 0.0 111.859 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.23 37.94 7.47 Favored Glycine 0 C--N 1.355 1.613 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' LYS . . . . . 0.496 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 54.8 mtpt -136.54 -169.5 2.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.418 0.687 . . . . 0.0 110.405 -171.636 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LEU . . . . . 0.504 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.6 mt -118.33 166.38 12.7 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.753 1.221 . . . . 0.0 109.979 176.906 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.5 tp -153.43 103.75 2.69 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -93.99 101.76 13.82 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -177.664 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.6 p -118.03 133.31 56.03 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.208 1.003 . . . . 0.0 109.861 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -82.58 162.37 21.97 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.505 0.722 . . . . 0.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -79.12 136.56 37.17 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.171 0.589 . . . . 0.0 110.108 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -94.32 139.67 30.78 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 165.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -65.79 110.26 2.76 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.571 0.748 . . . . 0.0 112.318 -168.803 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -82.82 162.49 21.63 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.151 0.98 . . . . 0.0 109.842 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 78.9 m 73.24 114.77 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.314 1.446 . . . . 0.0 109.897 -169.759 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -141.16 -171.74 3.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.717 0.807 . . . . 0.0 110.485 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.3 mp -71.18 138.48 84.52 Favored Pre-proline 0 CA--C 1.55 0.952 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.153 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.07 168.45 21.92 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 123.034 2.489 . . . . 0.0 112.919 -176.31 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -70.23 158.58 87.18 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.479 0.712 . . . . 0.0 110.916 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_exo -48.17 135.16 24.88 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.691 2.927 . . . . 0.0 114.753 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -94.66 159.98 14.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.189 0.996 . . . . 0.0 110.194 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -69.86 95.38 0.91 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.348 0.659 . . . . 0.0 109.491 172.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.8 mt -117.16 23.08 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.629 0 CA-C-O 122.806 1.289 . . . . 0.0 108.892 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -142.98 139.73 30.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.31 1.044 . . . . 0.0 108.796 177.145 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -140.87 31.78 1.8 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.299 0.639 . . . . 0.0 111.467 -172.502 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.41 111.83 7.94 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -84.92 140.8 30.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.531 0.733 . . . . 0.0 110.521 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.2 mt -68.5 150.1 48.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.4 0.437 . . . . 0.0 110.053 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 92.3 mt -86.97 151.93 52.71 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.468 -176.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -54.19 152.14 26.03 Favored 'Trans proline' 0 C--N 1.386 2.5 0 C-N-CA 123.06 2.507 . . . . 0.0 113.563 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.73 -33.11 71.22 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.196 0.599 . . . . 0.0 110.952 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.98 155.4 20.94 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 124.299 0.999 . . . . 0.0 109.243 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -108.49 23.32 14.7 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.525 ' HG3' HG13 ' A' ' 28' ' ' VAL . 17.6 tpp180 -88.55 95.98 10.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.375 0.67 . . . . 0.0 110.721 -176.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.57 90.22 4.52 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.863 0.465 . . . . 0.0 110.038 174.605 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.525 HG13 ' HG3' ' A' ' 26' ' ' ARG . 16.4 m -103.28 152.78 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.628 0.771 . . . . 0.0 109.438 170.065 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -62.02 157.13 19.49 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.583 0.753 . . . . 0.0 111.73 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 31.5 t -44.44 -40.59 5.62 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.962 1.705 . . . . 0.0 115.278 -174.73 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -64.22 -27.68 69.22 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 118.356 0.525 . . . . 0.0 111.44 -175.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.78 30.86 3.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.338 1.055 . . . . 0.0 111.007 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -48.3 -27.7 2.68 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.088 1.355 . . . . 0.0 114.439 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.6 mt -132.03 -53.27 0.98 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 -146.55 50.42 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.848 -172.519 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.31 -2.85 8.62 Favored 'Trans proline' 0 C--N 1.371 1.726 0 C-N-CA 122.582 2.188 . . . . 0.0 112.376 168.757 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -80.74 -60.1 2.43 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 123.822 0.849 . . . . 0.0 110.394 -176.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.28 -28.85 12.25 Favored Glycine 0 C--N 1.349 1.259 0 CA-C-O 119.662 -0.521 . . . . 0.0 114.37 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -134.43 95.42 3.38 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.109 0.954 . . . . 0.0 111.387 -177.304 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -143.11 161.36 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.396 0.678 . . . . 0.0 110.037 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 34.4 mt -89.72 124.83 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 C-N-CA 123.183 0.593 . . . . 0.0 109.62 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.513 HG23 ' HA ' ' A' ' 30' ' ' SER . 1.3 mp -81.86 119.45 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 C-N-CA 125.135 1.374 . . . . 0.0 109.438 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -96.24 109.44 21.92 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 175.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 49.6 t-80 -165.35 148.28 8.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.9 0.88 . . . . 0.0 109.872 -174.135 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 69.04 23.48 6.54 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.396 1.079 . . . . 0.0 111.142 171.319 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.48 24.32 76.19 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.909 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -138.6 177.98 7.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.855 1.262 . . . . 0.0 109.494 -175.767 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -134.32 149.34 50.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.765 0.826 . . . . 0.0 108.866 169.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.677 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 3.6 p90 -158.84 125.59 4.71 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.493 0.717 . . . . 0.0 111.159 176.639 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -75.24 115.83 15.31 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.184 0.994 . . . . 0.0 109.843 -172.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 59' ' ' LEU . 55.7 tp -109.97 124.39 51.34 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 8.0 ptm180 -129.93 152.21 49.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.027 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -90.56 108.31 19.72 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 p -72.57 136.63 45.85 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -60.25 -27.23 67.06 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.177 0.991 . . . . 0.0 112.218 -174.095 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.46 -22.79 55.85 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.186 0.994 . . . . 0.0 112.039 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.51 41.31 0.96 Allowed Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.626 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -137.01 172.68 12.65 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.318 0.58 . . . . 0.0 111.79 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.8 mt -106.84 148.26 28.74 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.158 169.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.9 tp -137.92 99.59 3.94 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -89.69 122.47 32.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 177.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.6 p -135.16 131.66 37.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.615 0.766 . . . . 0.0 109.766 -174.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.677 ' HD2' ' HB3' ' A' ' 49' ' ' TYR . 30.3 mmmt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.261 1.024 . . . . 0.0 108.701 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 110.644 -0.132 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.4 m -69.25 86.09 0.4 Allowed 'General case' 0 C--N 1.357 0.935 0 C-N-CA 123.72 0.808 . . . . 0.0 111.611 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.9 mtm180 -133.52 -41.44 0.87 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.095 1.358 . . . . 0.0 108.526 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.8 tpt 65.32 -101.43 0.08 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.933 1.693 . . . . 0.0 109.462 -171.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 172.86 75.44 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.852 1.261 . . . . 0.0 107.784 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 66.57 132.54 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 125.199 1.399 . . . . 0.0 111.844 -175.214 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.0 m -137.11 113.73 10.26 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.924 -0.485 . . . . 0.0 109.978 175.937 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -156.94 163.3 39.29 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.997 0.919 . . . . 0.0 109.975 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.2 mt -114.47 152.01 45.72 Favored Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 123.362 0.665 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -65.75 147.63 85.89 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 122.755 2.303 . . . . 0.0 111.779 175.381 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -83.59 139.64 41.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.158 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -46.92 131.33 16.71 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 124.084 3.189 . . . . 0.0 114.449 177.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -89.39 125.69 35.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.529 1.132 . . . . 0.0 109.337 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.99 144.03 26.44 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.0 mt -105.55 76.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.4 t70 63.56 170.78 0.16 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 124.719 1.208 . . . . 0.0 112.973 170.938 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -155.23 144.5 21.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.274 1.029 . . . . 0.0 109.236 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -130.8 -49.91 1.04 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.404 0.682 . . . . 0.0 110.071 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.6 t -69.25 143.7 53.84 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.68 0.792 . . . . 0.0 112.585 -172.051 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.5 mt -81.06 163.75 22.97 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.875 0.87 . . . . 0.0 109.428 168.749 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.7 138.68 24.96 Favored Pre-proline 0 N--CA 1.475 0.806 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.019 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -59.17 139.41 90.24 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.667 2.245 . . . . 0.0 111.776 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -55.87 -34.69 65.72 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.887 0.875 . . . . 0.0 111.488 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.39 159.04 19.22 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.798 1.239 . . . . 0.0 108.95 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -114.12 22.49 13.79 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.311 0.577 . . . . 0.0 109.865 171.408 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -85.47 103.22 14.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.11 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -79.75 107.82 12.82 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.5 m -122.56 153.17 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -62.75 164.75 7.4 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.968 0.507 . . . . 0.0 111.932 -174.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.2 m -55.35 -33.76 63.66 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.934 0.894 . . . . 0.0 112.916 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.87 -32.47 69.51 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.155 0.982 . . . . 0.0 111.776 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -105.04 31.25 4.96 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.576 1.15 . . . . 0.0 111.443 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.461 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.5 pt? -45.51 -24.64 0.34 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -174.563 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.53 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 82.4 mt -123.05 -58.52 1.64 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.658 0.663 . . . . 0.0 111.227 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.71 -155.36 46.57 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 123.849 0.718 . . . . 0.0 112.906 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -73.64 -16.03 24.11 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 123.023 2.482 . . . . 0.0 112.001 172.365 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -79.63 -54.51 5.81 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.27 1.028 . . . . 0.0 110.73 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 82.47 3.48 90.51 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.482 -171.5 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.514 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -147.96 89.58 1.75 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.203 1.001 . . . . 0.0 110.009 -177.26 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 m -145.35 170.8 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.787 0.835 . . . . 0.0 110.537 -176.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 26.0 mt -94.33 112.31 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 123.409 0.683 . . . . 0.0 109.913 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -70.8 115.89 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.754 1.621 . . . . 0.0 110.476 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.44 104.05 16.22 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 171.345 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -102.63 86.53 2.79 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 168.06 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.0 m120 55.08 55.46 7.63 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.175 1.39 . . . . 0.0 111.329 176.602 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.9 -26.33 13.25 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.682 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.37 106.05 13.93 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 10.2 pt-20 -101.8 124.48 47.52 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.211 0.604 . . . . 0.0 111.443 -171.507 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.656 ' HB3' ' HB3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.32 135.34 38.82 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.914 0.886 . . . . 0.0 109.633 178.192 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -78.26 129.55 35.2 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 59' ' ' LEU . 61.0 tp -122.98 136.63 54.93 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.606 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -141.09 142.63 34.11 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.365 0.416 . . . . 0.0 111.796 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -78.69 102.83 8.25 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.348 0.659 . . . . 0.0 109.497 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -73.47 133.75 43.74 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -70.47 -8.25 49.63 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 124.011 0.82 . . . . 0.0 110.702 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.92 -18.29 59.77 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.562 1.145 . . . . 0.0 111.718 167.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.51 34.35 3.89 Favored Glycine 0 C--N 1.344 0.973 0 C-N-CA 123.414 0.53 . . . . 0.0 112.74 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -144.08 175.22 10.21 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.334 0.588 . . . . 0.0 111.47 -175.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.631 ' HB3' HD11 ' A' ' 51' ' ' LEU . 30.8 mt -106.86 146.97 30.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.751 1.221 . . . . 0.0 108.858 165.537 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -132.86 102.23 5.56 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.407 0.683 . . . . 0.0 109.203 -175.883 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -88.94 103.23 15.84 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 43.8 p -109.03 135.02 50.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.674 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HB3' ' HB3' ' A' ' 49' ' ' TYR . 22.6 pttm . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 123.65 0.78 . . . . 0.0 110.326 -176.046 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.9 mtp . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m 60.02 88.62 0.07 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.9 1.28 . . . . 0.0 112.707 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -116.4 84.17 2.08 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.8 ttt -120.19 125.69 48.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.704 0.801 . . . . 0.0 109.104 173.819 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -149.06 142.87 25.64 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -145.54 46.98 1.29 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.224 0.61 . . . . 0.0 110.501 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 15.5 p -62.57 86.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.232 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -130.53 168.91 16.29 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.727 1.211 . . . . 0.0 108.718 177.252 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.92 126.39 92.57 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 123.514 0.726 . . . . 0.0 109.824 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -68.3 63.0 1.09 Allowed 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.824 3.016 . . . . 0.0 112.924 170.418 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -146.13 136.31 12.01 Favored Pre-proline 0 C--O 1.243 0.748 0 C-N-CA 125.79 1.636 . . . . 0.0 106.969 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.9 165.8 26.75 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 122.124 1.883 . . . . 0.0 111.239 174.209 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -78.92 81.01 5.24 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -69.48 116.3 9.73 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.465 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 79.3 mt -74.23 91.64 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.808 0.813 . . . . 0.0 109.174 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -128.74 93.83 3.71 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.211 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -96.01 119.01 33.74 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.326 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -124.22 39.28 4.01 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.411 0.684 . . . . 0.0 110.235 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.4 t -68.3 155.22 40.21 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.096 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.8 mt -72.12 156.96 38.61 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.159 0.584 . . . . 0.0 111.421 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.7 mt -83.15 152.51 65.2 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 -174.59 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.24 158.88 52.62 Favored 'Trans proline' 0 C--N 1.384 2.442 0 C-N-CA 122.919 2.412 . . . . 0.0 111.808 174.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.65 -60.61 2.29 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.54 149.55 9.87 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.161 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 35.0 mt-10 -100.45 28.53 4.97 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.962 0.905 . . . . 0.0 111.325 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -81.06 92.52 6.24 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.486 0.714 . . . . 0.0 111.099 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.472 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 11.1 mpt_? -74.48 106.77 6.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 174.193 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 m -140.5 145.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.782 1.233 . . . . 0.0 109.374 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' ASP . 59.8 t30 -60.95 159.95 10.58 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 -178.716 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.2 m -43.03 -30.43 0.43 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 174.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -55.49 -42.64 74.69 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.488 0.661 . . . . 0.0 111.175 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.94 37.54 1.94 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.557 1.143 . . . . 0.0 110.841 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.562 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -54.33 -22.46 12.18 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.536 HD13 ' HD2' ' A' ' 53' ' ' LYS . 96.0 mt -134.65 -52.53 0.81 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.253 0.549 . . . . 0.0 109.554 174.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.67 -152.26 50.33 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.024 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.35 3.8 6.7 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.83 2.353 . . . . 0.0 112.837 170.03 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.13 -58.16 2.56 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.595 0.758 . . . . 0.0 109.873 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.55 -22.91 29.55 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.364 -0.686 . . . . 0.0 113.779 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -133.67 101.27 5.05 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-N 118.493 1.147 . . . . 0.0 111.276 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.4 m -142.07 167.83 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 121.816 -0.552 . . . . 0.0 111.335 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.435 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 59.8 mt -92.68 111.62 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.47 1.108 . . . . 0.0 108.868 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -80.77 111.24 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.162 0.985 . . . . 0.0 109.663 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 29' ' ' ASN . 19.3 t70 -89.11 122.13 32.12 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.885 1.274 . . . . 0.0 107.935 174.163 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -171.48 143.55 1.8 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.276 0.63 . . . . 0.0 110.723 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.0 t30 62.92 21.34 12.81 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 124.696 1.198 . . . . 0.0 112.18 170.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.06 -4.49 78.01 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 121.872 -0.517 . . . . 0.0 113.527 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -120.26 171.7 8.31 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.718 0.771 . . . . 0.0 111.512 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.435 ' HB2' ' CG2' ' A' ' 41' ' ' ILE . 1.0 OUTLIER -129.82 137.73 50.62 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.294 179.556 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.509 ' HD1' ' HE3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -137.18 118.1 14.23 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.513 0.725 . . . . 0.0 109.087 -178.723 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -76.5 103.41 6.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.426 0.69 . . . . 0.0 109.235 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.462 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -104.68 118.74 37.33 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -123.85 134.51 53.57 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 123.764 0.665 . . . . 0.0 109.859 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.6 mtpm? -79.31 99.25 7.02 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 173.187 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -62.69 136.62 57.97 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 176.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -70.42 -4.83 24.42 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.636 0.774 . . . . 0.0 111.704 -177.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.35 -11.84 60.17 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.57 1.148 . . . . 0.0 112.071 166.06 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.58 40.07 5.13 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 123.539 0.59 . . . . 0.0 112.289 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -140.89 170.84 14.99 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.87 0.468 . . . . 0.0 110.726 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD11 ' A' ' 51' ' ' LEU . 72.1 mt -106.78 139.73 40.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.479 1.112 . . . . 0.0 109.498 172.795 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -127.12 100.95 6.32 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.82 113.79 25.41 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.5 p -130.31 -179.12 5.07 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.972 1.309 . . . . 0.0 108.17 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HE3' ' HD1' ' A' ' 49' ' ' TYR . 46.1 mmtm . . . . . 0 C--O 1.251 1.168 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 p -150.22 133.22 16.13 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.278 0.631 . . . . 0.0 109.898 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -80.19 146.97 31.48 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.275 0.63 . . . . 0.0 111.191 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' A' ' 4' ' ' MET . 1.5 mpt? -100.44 72.8 1.61 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 171.573 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -80.01 -7.29 58.76 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.377 -173.906 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -55.77 127.63 31.03 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.946 0.898 . . . . 0.0 111.531 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.6 t -160.69 125.26 3.66 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.777 0.831 . . . . 0.0 109.656 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -124.49 90.57 3.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.769 0.827 . . . . 0.0 109.798 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -74.04 161.51 78.14 Favored Pre-proline 0 CA--C 1.556 1.201 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.273 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -40.77 139.22 1.35 Allowed 'Trans proline' 0 C--N 1.393 2.876 0 C-N-CA 123.905 3.07 . . . . 0.0 114.267 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -162.17 166.06 14.77 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.263 1.025 . . . . 0.0 110.174 -166.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -51.09 141.54 37.66 Favored 'Trans proline' 0 C--N 1.387 2.553 0 C-N-CA 123.151 2.568 . . . . 0.0 114.384 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -73.84 135.6 43.43 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.531 0.732 . . . . 0.0 110.995 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -66.46 114.37 5.4 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.213 1.005 . . . . 0.0 111.361 -173.279 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.3 mt -98.71 94.83 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.484 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -95.62 148.58 22.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.268 0.627 . . . . 0.0 109.996 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -74.62 87.27 2.15 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.062 0.458 . . . . 0.0 109.967 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -7.36 59.55 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.741 0.816 . . . . 0.0 110.854 177.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.3 m -52.08 128.6 25.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.181 1.392 . . . . 0.0 112.505 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.0 mt -73.68 158.6 34.39 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.693 0.797 . . . . 0.0 110.878 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mp -88.63 149.26 43.73 Favored Pre-proline 0 CA--C 1.546 0.799 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.617 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.28 150.38 88.41 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 122.816 2.344 . . . . 0.0 111.565 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.11 -54.14 45.49 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.727 0.411 . . . . 0.0 110.377 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.63 149.23 26.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.841 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.43 24.13 13.17 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.721 0.808 . . . . 0.0 109.366 171.104 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -83.31 90.24 7.11 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.177 0.991 . . . . 0.0 110.123 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -77.58 96.49 4.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.2 m -119.99 156.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.431 1.092 . . . . 0.0 109.198 171.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -59.27 155.74 13.83 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.941 0.896 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -51.93 -26.81 11.15 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.584 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.6 -35.83 73.05 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.445 0.698 . . . . 0.0 111.701 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.71 40.63 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.946 0.898 . . . . 0.0 109.908 177.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -47.17 -16.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 177.188 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.526 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.1 mt -119.17 -32.18 4.48 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 121.728 -0.608 . . . . 0.0 110.636 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.25 -166.26 37.89 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.958 -177.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.21 -10.32 19.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 122.631 2.22 . . . . 0.0 112.097 173.853 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -91.65 -24.12 19.63 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.785 0.834 . . . . 0.0 110.625 -175.496 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.46 -6.29 73.6 Favored Glycine 0 C--N 1.35 1.357 0 O-C-N 123.165 0.291 . . . . 0.0 112.592 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.63 110.2 3.8 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.136 0.974 . . . . 0.0 108.956 -177.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.2 m -146.75 171.89 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.448 0.699 . . . . 0.0 110.742 -176.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.6 mt -92.54 116.12 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.457 171.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.46 136.11 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 125.21 1.404 . . . . 0.0 109.505 174.064 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -115.03 118.34 33.13 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 124.406 1.082 . . . . 0.0 108.404 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -152.45 113.81 4.27 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.458 0.473 . . . . 0.0 111.065 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 t30 63.54 28.9 15.34 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.821 1.248 . . . . 0.0 111.044 171.779 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.51 2.55 87.15 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.452 -0.794 . . . . 0.0 114.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -111.02 128.57 55.9 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.838 0.855 . . . . 0.0 109.086 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 15.4 pt-20 -113.02 137.82 50.82 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.284 0.634 . . . . 0.0 110.957 -175.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -135.31 149.53 49.78 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -100.35 109.51 21.69 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.854 0.752 . . . . 0.0 109.071 177.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 59' ' ' LEU . 51.0 tp -107.34 125.85 51.72 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.09 135.66 48.48 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 123.915 0.76 . . . . 0.0 110.54 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.526 ' HD2' HD13 ' A' ' 34' ' ' LEU . 62.0 mtpt -77.01 108.01 9.77 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.744 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -72.29 139.53 48.07 Favored 'General case' 0 C--O 1.249 1.039 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -74.07 -4.72 37.24 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.7 0.625 . . . . 0.0 111.015 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.8 -23.85 67.37 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 110.789 165.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.1 36.99 2.05 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.349 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -134.12 177.66 7.57 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.313 0.578 . . . . 0.0 111.413 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.493 ' HB3' HD11 ' A' ' 51' ' ' LEU . 89.6 mt -114.07 138.86 49.84 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.135 1.374 . . . . 0.0 108.35 169.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -133.28 102.27 5.49 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -174.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -86.06 121.8 29.18 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.9 p -130.49 158.62 39.44 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.996 0.918 . . . . 0.0 109.643 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 124.157 0.983 . . . . 0.0 109.01 -177.777 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtt . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 m -74.54 90.17 2.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.142 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -166.75 137.01 3.15 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 124.06 0.944 . . . . 0.0 110.293 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.47 ' HG3' ' HG2' ' A' ' 8' ' ' GLU . 15.2 ptp -159.66 92.0 1.02 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.5 t70 55.14 57.31 5.64 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.393 1.077 . . . . 0.0 108.631 -166.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 38.7 t30 61.46 -80.71 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 114.062 -1.426 . . . . 0.0 108.833 -163.02 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.0 m -150.4 103.38 3.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.138 0.975 . . . . 0.0 108.529 171.491 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HG2' ' HG3' ' A' ' 4' ' ' MET . 10.2 pt-20 -75.12 111.06 9.96 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 173.19 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.35 79.55 48.54 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 123.347 0.659 . . . . 0.0 112.151 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.83 -174.52 2.27 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 122.718 2.278 . . . . 0.0 111.267 169.298 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -81.82 118.26 71.44 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.925 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -65.84 99.76 0.4 Allowed 'Trans proline' 0 C--N 1.379 2.18 0 C-N-CA 122.944 2.43 . . . . 0.0 112.649 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -67.43 -67.31 0.47 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 171.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -178.62 110.48 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.997 1.319 . . . . 0.0 108.511 173.106 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.5 mt -95.52 69.21 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -168.6 161.57 11.52 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.635 -178.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -144.37 97.51 3.05 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.115 0.566 . . . . 0.0 110.353 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -143.73 114.37 7.61 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 163.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.0 m -80.22 85.98 5.68 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.694 0.759 . . . . 0.0 110.66 -171.71 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.35 167.85 15.19 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.81 -1.087 . . . . 0.0 109.947 176.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 69.21 139.94 0.07 OUTLIER Pre-proline 0 N--CA 1.493 1.675 0 C-N-CA 124.305 1.042 . . . . 0.0 112.084 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.55 132.94 32.63 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 122.082 1.855 . . . . 0.0 110.129 168.144 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.59 -37.81 58.85 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.744 0.818 . . . . 0.0 112.496 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.58 -172.72 2.51 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 124.446 1.092 . . . . 0.0 110.398 175.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.25 27.17 8.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.323 1.049 . . . . 0.0 109.95 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -72.63 76.64 1.09 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.255 1.022 . . . . 0.0 109.524 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.42 ' HA ' ' HB ' ' A' ' 41' ' ' ILE . 2.7 ttm180 -82.91 86.23 6.99 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -171.966 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.5 m -113.67 154.0 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.227 1.011 . . . . 0.0 109.763 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.39 152.08 11.97 Favored 'General case' 0 CA--C 1.555 1.168 0 O-C-N 123.716 0.635 . . . . 0.0 111.042 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -50.04 -24.98 2.98 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -58.22 -33.4 69.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.729 0.412 . . . . 0.0 111.587 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.48 35.3 3.12 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.456 1.102 . . . . 0.0 110.401 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -53.62 -19.01 3.4 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.464 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.0 mt -133.11 -65.91 0.68 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 168.765 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.0 -155.29 53.15 Favored Glycine 0 CA--C 1.533 1.188 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.465 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -80.8 2.8 8.28 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 123.035 2.49 . . . . 0.0 112.828 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -97.79 -59.0 1.86 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.342 1.057 . . . . 0.0 109.465 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.27 -11.16 65.5 Favored Glycine 0 C--N 1.347 1.143 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HD2' ' O ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -141.54 78.74 1.65 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 122.866 1.317 . . . . 0.0 110.868 -175.839 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.98 159.94 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.773 -168.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 27' ' ' ARG . 50.7 mt -90.15 110.58 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.766 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.35 105.15 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.634 1.174 . . . . 0.0 109.997 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.3 121.7 24.77 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 166.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -145.83 100.3 3.39 Favored 'General case' 0 C--O 1.239 0.537 0 O-C-N 124.038 0.836 . . . . 0.0 109.101 -177.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 61.61 23.24 13.58 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.152 1.381 . . . . 0.0 111.641 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.79 -22.35 40.0 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.653 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -80.92 111.56 17.5 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.5 pt-20 -104.46 131.27 52.03 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.524 0.729 . . . . 0.0 110.222 -175.88 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HD2' HD21 ' A' ' 61' ' ' LEU . 5.6 p90 -148.52 123.86 10.27 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.124 0.57 . . . . 0.0 111.883 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.12 110.84 8.74 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.033 1.333 . . . . 0.0 110.061 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 59' ' ' LEU . 53.7 tp -104.37 129.41 52.29 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -131.93 133.86 45.01 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.546 0.529 . . . . 0.0 111.255 -174.47 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.464 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.5 mtpt -85.11 105.0 15.51 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.953 0.901 . . . . 0.0 109.491 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.1 p -71.92 145.27 48.59 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -63.3 -20.49 65.53 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 124.708 1.255 . . . . 0.0 112.323 -175.469 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . . . -64.77 -15.72 62.03 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.819 0.848 . . . . 0.0 111.767 172.786 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.93 37.94 4.78 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 124.27 0.938 . . . . 0.0 111.95 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 56' ' ' ALA . 43.9 mtmt -127.64 161.44 28.86 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 120.809 0.337 . . . . 0.0 111.417 -173.612 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.565 ' HB3' HD11 ' A' ' 51' ' ' LEU . 48.3 mt -110.34 126.81 54.63 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.187 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -115.93 114.69 25.0 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.747 1.219 . . . . 0.0 108.82 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.568 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.8 tm? -102.36 100.4 10.55 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.5 p -105.73 152.82 22.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.515 1.126 . . . . 0.0 108.922 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 123.13 0.572 . . . . 0.0 109.985 177.857 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 m -69.46 84.44 0.41 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.476 0.71 . . . . 0.0 109.756 174.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -83.94 77.13 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.342 0.657 . . . . 0.0 110.773 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.58 102.06 14.49 Favored 'General case' 0 C--N 1.348 0.513 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.453 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -148.54 119.15 7.46 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -155.84 146.07 21.63 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.183 0.993 . . . . 0.0 108.957 -177.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -155.63 153.48 30.12 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.384 0.674 . . . . 0.0 109.48 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.81 104.62 11.45 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 171.86 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.6 mt -61.58 111.04 3.72 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 124.702 1.201 . . . . 0.0 111.627 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -93.19 -175.28 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 123.09 2.527 . . . . 0.0 112.336 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -158.0 58.37 1.4 Allowed Pre-proline 0 CA--C 1.554 1.127 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.978 172.859 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -65.53 143.98 77.49 Favored 'Trans proline' 0 C--N 1.38 2.189 0 C-N-CA 122.038 1.825 . . . . 0.0 111.115 -179.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -73.33 82.36 1.39 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.199 0.523 . . . . 0.0 109.879 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.17 98.1 7.18 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.636 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.2 mt -76.08 78.37 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 121.663 0.744 . . . . 0.0 109.73 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -93.69 -57.08 2.67 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -169.43 22.87 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.07 0 O-C-N 124.339 1.024 . . . . 0.0 110.07 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -64.74 116.22 6.06 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-O 121.714 0.769 . . . . 0.0 111.369 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.2 m -146.82 143.55 28.68 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.158 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.76 169.38 16.83 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-O 121.179 0.514 . . . . 0.0 110.806 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -70.2 163.58 60.65 Favored Pre-proline 0 CA--C 1.557 1.233 0 C-N-CA 123.811 0.844 . . . . 0.0 110.484 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -48.06 142.49 15.68 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.477 2.118 . . . . 0.0 112.353 169.289 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.34 -35.24 50.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.522 0.729 . . . . 0.0 111.797 -177.195 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -147.43 148.66 31.51 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 166.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -96.61 35.1 1.55 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.4 0.68 . . . . 0.0 109.882 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -95.0 92.23 6.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.823 0.849 . . . . 0.0 110.059 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -80.51 90.63 5.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 121.256 0.55 . . . . 0.0 109.798 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -117.64 157.58 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.158 0.983 . . . . 0.0 109.407 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -48.41 154.65 0.6 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 125.263 1.425 . . . . 0.0 112.813 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.6 m -54.59 -30.6 54.99 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.767 0.827 . . . . 0.0 111.568 170.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -53.52 -41.15 66.07 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.898 0.879 . . . . 0.0 111.683 172.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.65 36.72 2.33 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.837 0.855 . . . . 0.0 110.847 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -51.44 -21.54 2.43 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 114.671 1.359 . . . . 0.0 114.671 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.518 HD13 ' HD2' ' A' ' 53' ' ' LYS . 98.5 mt -123.25 -42.93 2.22 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.29 -157.66 52.59 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.892 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.64 3.69 7.52 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.852 2.368 . . . . 0.0 112.315 173.941 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -99.76 -54.06 3.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.304 1.042 . . . . 0.0 110.239 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 108.31 -11.34 36.63 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.824 -0.625 . . . . 0.0 114.459 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 pptp? -146.69 111.7 5.38 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 117.887 0.844 . . . . 0.0 110.772 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.8 m -147.06 167.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 124.219 1.008 . . . . 0.0 109.908 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.452 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 58.9 mt -90.75 120.85 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 172.544 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -79.77 110.17 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 124.897 1.279 . . . . 0.0 110.376 -177.749 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.93 137.43 34.21 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.673 167.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -160.27 95.69 1.15 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.248 1.019 . . . . 0.0 109.227 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.6 m120 65.06 31.18 11.28 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.3 1.04 . . . . 0.0 111.667 172.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.5 -15.16 62.51 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.999 -0.546 . . . . 0.0 113.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -87.61 142.92 27.47 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.8 pt-20 -129.31 137.13 50.84 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -152.41 124.8 8.21 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.487 0.715 . . . . 0.0 110.997 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -70.82 122.9 20.75 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.524 1.13 . . . . 0.0 109.912 -175.086 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.2 tp -113.27 127.2 56.08 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 168.512 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 ptm180 -128.48 135.62 49.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -75.95 99.36 4.51 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 166.627 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -65.17 138.73 58.45 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.39 -5.7 25.25 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 123.889 0.743 . . . . 0.0 111.57 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.22 -14.63 61.11 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.065 0.946 . . . . 0.0 111.492 165.742 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 33.29 6.57 Favored Glycine 0 C--N 1.352 1.452 0 C-N-CA 124.061 0.839 . . . . 0.0 112.024 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -137.9 -175.21 4.01 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.96 0.504 . . . . 0.0 110.703 -173.534 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.1 mt -112.26 159.07 18.98 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.716 1.206 . . . . 0.0 109.774 171.829 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.7 tp -147.11 105.92 3.84 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.177 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.469 HD21 ' HD2' ' A' ' 49' ' ' TYR . 2.4 tm? -99.6 101.21 12.35 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.0 p -120.11 132.68 55.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.055 0.942 . . . . 0.0 110.031 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' HB3' ' A' ' 49' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.284 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 171.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.5 mtt . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -104.18 113.81 27.62 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.41 0.684 . . . . 0.0 109.807 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -75.65 117.48 17.46 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.048 0.539 . . . . 0.0 110.024 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.0 ttt -145.87 152.36 39.35 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.929 0.892 . . . . 0.0 108.901 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 67.21 102.52 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.622 1.169 . . . . 0.0 110.747 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -70.22 135.82 49.39 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.366 0.666 . . . . 0.0 110.228 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 m -75.09 147.66 40.4 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.427 0.691 . . . . 0.0 109.817 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -69.9 156.04 39.67 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.482 0.713 . . . . 0.0 111.266 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.0 mt -60.26 146.53 83.6 Favored Pre-proline 0 CA--C 1.56 1.347 0 C-N-CA 124.209 1.003 . . . . 0.0 111.639 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.77 167.83 23.31 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 122.541 2.161 . . . . 0.0 112.767 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -93.38 143.44 26.68 Favored Pre-proline 0 N--CA 1.478 0.965 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.886 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.49 146.22 84.74 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.229 2.62 . . . . 0.0 113.735 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' HG3' ' HG3' ' A' ' 14' ' ' GLU . 17.4 ptpt -66.66 -31.66 72.48 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.778 0.831 . . . . 0.0 110.484 175.105 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . 0.403 ' HG3' ' HG3' ' A' ' 13' ' ' LYS . 43.7 mt-10 -122.84 97.4 5.43 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.261 1.024 . . . . 0.0 108.29 175.003 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.7 mt -85.23 66.95 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 176.39 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 58.81 112.3 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 125.408 1.483 . . . . 0.0 113.06 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 4.7 p-10 -142.93 126.26 16.61 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.824 0.449 . . . . 0.0 110.844 176.714 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -101.38 77.47 1.78 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 m -73.62 106.26 5.31 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.151 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -75.95 179.4 5.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.704 0.802 . . . . 0.0 112.107 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.86 141.9 90.28 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.434 1.093 . . . . 0.0 110.797 -177.305 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.6 160.12 35.06 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.749 2.3 . . . . 0.0 112.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -67.72 -54.03 22.69 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 122.847 0.459 . . . . 0.0 110.944 -177.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -170.67 141.87 1.92 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.804 0.69 . . . . 0.0 110.349 178.73 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -94.34 40.33 1.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.343 0.657 . . . . 0.0 110.38 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.463 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.0 tpm_? -91.15 90.69 7.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.067 0.947 . . . . 0.0 109.427 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.66 91.36 5.84 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.463 HG13 ' HG3' ' A' ' 26' ' ' ARG . 22.8 m -107.6 162.87 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.046 0.938 . . . . 0.0 109.172 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -66.13 164.03 16.4 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.859 0.463 . . . . 0.0 111.724 176.607 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 41.7 t -57.72 -28.7 64.11 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.388 1.075 . . . . 0.0 112.924 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -59.34 -32.65 70.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.052 0.541 . . . . 0.0 110.674 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.34 40.36 1.78 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.119 0.968 . . . . 0.0 110.117 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.512 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -46.54 -21.45 0.18 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.534 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -122.43 -33.0 3.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.923 0.489 . . . . 0.0 110.651 174.795 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.51 -152.56 52.36 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.296 -0.724 . . . . 0.0 112.445 -173.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.17 -13.69 12.44 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.667 2.245 . . . . 0.0 112.504 171.309 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -90.22 -43.0 10.7 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.882 0.873 . . . . 0.0 111.506 -170.137 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.474 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 94.58 -16.17 61.74 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.065 -171.913 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.537 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 6.5 ptpp? -130.36 93.28 3.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.736 0.814 . . . . 0.0 110.383 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.8 m -141.66 164.99 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.802 0.841 . . . . 0.0 110.515 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.0 mt -90.17 120.64 39.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.351 0.66 . . . . 0.0 109.243 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.512 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -78.76 132.01 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.032 1.333 . . . . 0.0 109.156 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.17 118.67 34.66 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 172.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' HIS . . . . . 0.492 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 6.1 t-80 -153.43 130.28 10.92 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.726 1.21 . . . . 0.0 110.735 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.63 5.89 88.25 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.414 -0.357 . . . . 0.0 113.064 -172.454 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -94.51 154.69 17.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.827 0.851 . . . . 0.0 109.753 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -123.36 131.59 53.7 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.25 0.62 . . . . 0.0 111.008 -171.876 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HB2' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -144.98 120.89 10.64 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.367 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -80.73 107.19 13.33 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.768 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.461 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.1 tp -103.09 123.62 47.0 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.107 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.452 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 7.9 ptm180 -128.92 133.47 47.88 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.293 -176.265 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -79.02 105.81 10.62 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 172.379 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -70.5 143.64 51.63 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.183 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -73.62 -3.34 27.41 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.867 0.867 . . . . 0.0 112.451 -174.208 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.83 -7.58 56.85 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.905 0.882 . . . . 0.0 110.912 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.29 37.19 5.69 Favored Glycine 0 C--N 1.35 1.32 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.595 177.175 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -129.5 166.69 19.14 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 120.987 0.422 . . . . 0.0 111.576 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.461 ' HB3' HD11 ' A' ' 51' ' ' LEU . 56.3 mt -104.7 127.24 52.4 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.137 0.975 . . . . 0.0 108.907 172.15 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.0 tp -121.0 103.17 8.83 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 49' ' ' TYR . 2.4 tm? -88.3 111.84 22.15 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.491 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.4 p -122.61 137.69 54.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.435 1.094 . . . . 0.0 108.959 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt . . . . . 0 CA--C 1.554 1.099 0 C-N-CA 123.652 0.781 . . . . 0.0 109.015 -175.961 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.9 m -109.58 103.76 12.69 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 175.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 73.1 ttt-85 -128.03 -44.48 1.45 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.791 0.837 . . . . 0.0 110.29 -173.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 58.3 mtt 68.47 -165.65 0.19 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.752 1.221 . . . . 0.0 109.659 -165.437 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -142.76 78.17 1.6 Allowed 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.229 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -134.51 77.22 1.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.616 0.767 . . . . 0.0 109.854 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.6 m -99.1 154.27 18.25 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.775 171.521 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -67.96 154.67 41.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.95 0.9 . . . . 0.0 110.625 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.6 mt -61.13 119.41 45.3 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 123.553 0.741 . . . . 0.0 110.5 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.35 99.65 0.1 Allowed 'Trans proline' 0 C--N 1.382 2.319 0 C-N-CA 123.083 2.522 . . . . 0.0 112.882 -175.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -76.29 111.85 17.72 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -89.36 175.11 3.4 Favored 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 122.738 2.292 . . . . 0.0 112.621 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -130.33 113.97 15.03 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 173.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -91.31 135.4 33.84 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.585 0.754 . . . . 0.0 109.532 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 62.0 mt -120.78 124.85 73.24 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.885 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -106.38 148.68 27.8 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.548 0.739 . . . . 0.0 109.089 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -81.58 76.3 8.5 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 121.733 0.777 . . . . 0.0 109.002 176.178 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -141.0 19.79 2.29 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.673 1.189 . . . . 0.0 109.356 176.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.6 m -53.33 135.33 39.07 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.761 1.225 . . . . 0.0 111.656 -176.18 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.4 170.29 5.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.492 0.717 . . . . 0.0 111.836 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mp 69.64 164.89 0.13 Allowed Pre-proline 0 N--CA 1.49 1.545 0 C-N-CA 124.323 1.049 . . . . 0.0 110.622 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -54.0 140.11 69.9 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 121.809 1.673 . . . . 0.0 110.973 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.89 -28.03 67.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.023 0.529 . . . . 0.0 111.58 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.01 142.39 10.29 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.675 1.19 . . . . 0.0 108.061 167.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.471 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 11.0 pt-20 -90.59 31.89 1.01 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.313 0.577 . . . . 0.0 111.115 178.309 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -84.14 94.63 8.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.536 1.134 . . . . 0.0 109.646 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.471 ' NH1' ' HB2' ' A' ' 25' ' ' GLU . 8.8 mpt_? -76.42 105.1 7.28 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.586 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.7 m -121.86 159.66 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.163 0.985 . . . . 0.0 108.906 170.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.51 155.17 33.73 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.066 0.546 . . . . 0.0 109.661 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -55.33 -20.99 13.2 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.85 1.26 . . . . 0.0 113.714 -175.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -56.9 -38.79 73.31 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.382 0.673 . . . . 0.0 110.787 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.87 40.79 1.38 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.131 0.972 . . . . 0.0 110.511 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.21 -18.44 0.59 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 124.792 1.237 . . . . 0.0 114.232 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.24 -57.41 1.49 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.737 0.815 . . . . 0.0 109.488 167.92 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.27 -154.24 52.41 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.259 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -75.9 -17.56 17.54 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.435 2.09 . . . . 0.0 111.701 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.99 -41.75 73.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.28 1.032 . . . . 0.0 110.462 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.63 -5.81 49.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.795 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.62 105.3 2.42 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.575 1.15 . . . . 0.0 108.745 -178.214 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.8 m -144.22 169.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -173.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' TYR . 55.5 mt -90.07 110.87 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 114.353 -1.294 . . . . 0.0 108.63 169.471 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.516 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.8 132.28 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.208 1.403 . . . . 0.0 109.25 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -105.35 107.68 18.8 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 164.672 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -123.9 96.6 5.01 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -177.785 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 t30 60.61 42.44 13.95 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.59 1.156 . . . . 0.0 109.702 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.64 -18.7 28.48 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.82 -1.082 . . . . 0.0 114.072 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -83.96 118.55 24.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.802 0.841 . . . . 0.0 110.289 -176.096 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -88.56 133.12 34.26 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.799 0.439 . . . . 0.0 110.849 -179.669 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 41' ' ' ILE . 5.5 m-85 -131.14 177.45 7.45 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.78 108.39 9.83 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 59' ' ' LEU . 47.0 tp -104.41 124.19 48.78 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.446 ' HE ' HG22 ' A' ' 54' ' ' THR . 13.0 ptt180 -125.96 136.94 53.59 Favored 'General case' 0 C--O 1.242 0.67 0 O-C-N 123.482 0.488 . . . . 0.0 110.642 -177.539 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -79.15 99.12 6.83 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 168.671 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.446 HG22 ' HE ' ' A' ' 52' ' ' ARG . 35.8 p -68.62 149.06 49.59 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.748 178.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.33 -10.36 59.69 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 124.702 1.251 . . . . 0.0 113.218 -169.73 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.85 -14.34 59.91 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.472 0.709 . . . . 0.0 110.68 170.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.57 43.46 2.31 Favored Glycine 0 C--N 1.352 1.465 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.967 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -134.07 -179.49 5.59 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 116.806 0.303 . . . . 0.0 111.402 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 51' ' ' LEU . 83.5 mt -124.14 129.41 50.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.844 1.258 . . . . 0.0 109.818 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -123.56 105.1 9.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.674 0.79 . . . . 0.0 109.347 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' A' ' 51' ' ' LEU . 3.3 tm? -96.9 100.39 11.92 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.3 p -130.71 135.53 47.9 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.224 1.01 . . . . 0.0 109.617 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 123.94 0.896 . . . . 0.0 109.183 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.2 m -72.75 147.31 45.7 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.033 0.533 . . . . 0.0 110.69 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -153.01 104.24 2.81 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 57.3 ttm -76.5 90.48 3.29 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.606 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -64.97 111.06 2.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.63 0.772 . . . . 0.0 110.502 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -84.92 160.45 20.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.302 0.641 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 87.9 m -76.8 135.43 38.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.29 0.636 . . . . 0.0 110.35 175.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -86.07 -177.88 6.4 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.456 0.702 . . . . 0.0 111.412 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.77 149.18 70.48 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 123.139 0.576 . . . . 0.0 111.551 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -62.22 174.97 2.24 Favored 'Trans proline' 0 C--N 1.382 2.333 0 C-N-CA 123.665 2.91 . . . . 0.0 113.818 173.882 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -70.88 137.42 85.17 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 123.558 0.743 . . . . 0.0 110.247 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.88 -169.21 0.64 Allowed 'Trans proline' 0 C--N 1.376 2.012 0 C-N-CA 122.698 2.265 . . . . 0.0 112.509 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -105.35 164.63 11.71 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.856 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -70.97 163.65 27.1 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.132 0.573 . . . . 0.0 110.02 168.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 60.3 mt -79.53 138.97 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -102.33 115.88 31.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.075 0.95 . . . . 0.0 109.141 178.532 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -124.57 110.01 13.91 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.222 0.609 . . . . 0.0 110.244 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -118.75 29.54 7.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.176 0.99 . . . . 0.0 110.486 -175.62 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 20.5 m -63.0 119.05 8.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.545 0.738 . . . . 0.0 111.124 -176.263 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -72.44 164.01 27.08 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.472 0.709 . . . . 0.0 110.72 178.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.0 mp -83.68 154.28 65.03 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.576 177.14 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.77 148.61 87.41 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 122.247 1.965 . . . . 0.0 111.038 168.343 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.08 69.27 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.508 0.723 . . . . 0.0 111.589 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.43 161.65 42.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.397 170.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -114.41 22.85 13.32 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.978 0.511 . . . . 0.0 109.987 171.155 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -77.18 88.61 3.64 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -77.14 87.85 3.61 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 121.803 0.811 . . . . 0.0 110.11 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -116.8 159.32 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 114.46 -1.246 . . . . 0.0 109.347 178.331 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -59.37 161.43 5.65 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.913 0.885 . . . . 0.0 112.248 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.9 p -54.41 -30.33 51.92 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.068 0.947 . . . . 0.0 113.377 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -62.65 -30.79 71.63 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.643 0.377 . . . . 0.0 111.728 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.06 34.72 2.93 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.069 0.948 . . . . 0.0 110.661 176.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.421 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -49.48 -17.91 0.35 Allowed 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.529 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -125.58 -41.92 1.98 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.118 0.567 . . . . 0.0 110.089 174.133 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.67 -162.89 44.4 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.174 0.921 . . . . 0.0 112.699 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.5 -15.34 34.32 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.549 2.166 . . . . 0.0 112.274 172.445 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.92 -40.66 46.41 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.06 0.944 . . . . 0.0 111.165 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.51 -6.63 83.09 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.347 -169.583 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.03 122.05 7.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.497 1.119 . . . . 0.0 109.501 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.2 m -152.33 172.45 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.812 0.845 . . . . 0.0 110.248 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.3 mt -93.39 116.75 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 167.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 51' ' ' LEU . 1.4 mp -76.32 123.0 31.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 124.596 1.158 . . . . 0.0 109.302 177.6 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -97.75 122.01 40.33 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -157.94 117.18 3.22 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 123.314 0.646 . . . . 0.0 109.639 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.5 m120 66.88 16.97 10.49 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.78 1.232 . . . . 0.0 111.92 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.39 75.04 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 122.989 0.328 . . . . 0.0 113.069 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -90.46 156.98 17.81 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.751 0.82 . . . . 0.0 110.206 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.23 126.02 38.2 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.742 0.817 . . . . 0.0 109.717 -177.122 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.7 136.79 27.66 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.178 0.591 . . . . 0.0 109.655 177.244 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -84.63 123.98 30.95 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.039 0.935 . . . . 0.0 109.301 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.48 HD11 ' HB3' ' A' ' 59' ' ' LEU . 59.2 tp -119.5 136.8 54.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.599 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -139.76 143.83 37.13 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.499 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.529 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.4 mtpm? -83.02 98.99 9.56 Favored 'General case' 0 C--N 1.347 0.478 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -63.63 139.26 58.75 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -74.0 1.55 10.67 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -175.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.97 -18.79 63.37 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.548 0.739 . . . . 0.0 110.838 164.791 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.63 33.42 4.15 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.903 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.423 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.6 mtpt -134.94 -178.07 4.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.7 0.8 . . . . 0.0 111.253 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.48 ' HB3' HD11 ' A' ' 51' ' ' LEU . 69.8 mt -108.24 166.46 10.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.312 1.045 . . . . 0.0 109.99 169.141 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.4 tp -152.33 106.16 3.11 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.39 101.1 13.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -103.91 164.46 11.68 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.244 1.018 . . . . 0.0 108.991 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.255 1.347 0 CA-C-O 118.631 -0.699 . . . . 0.0 109.435 176.912 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 tpp . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m 62.38 16.24 8.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.295 1.038 . . . . 0.0 113.504 171.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.536 ' HA ' ' HB2' ' A' ' 6' ' ' ASN . 98.0 mtt180 -92.31 -11.7 34.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.236 0.614 . . . . 0.0 112.646 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -61.19 -37.32 82.54 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.21 0.528 . . . . 0.0 109.756 174.437 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -134.04 94.68 3.29 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' ' 3' ' ' ARG . 62.1 t30 -124.57 158.92 31.83 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.998 0.919 . . . . 0.0 108.809 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.4 m -69.17 110.19 4.43 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.043 0.537 . . . . 0.0 111.323 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -77.24 159.62 29.5 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.706 0.802 . . . . 0.0 109.035 171.551 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.9 mt -59.98 110.65 2.99 Favored Pre-proline 0 N--CA 1.481 1.077 0 C-N-CA 123.276 0.63 . . . . 0.0 111.317 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -92.71 166.12 2.71 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.853 2.369 . . . . 0.0 112.346 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -146.88 111.89 4.16 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 123.864 0.865 . . . . 0.0 109.65 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -74.79 155.48 43.95 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.749 2.299 . . . . 0.0 111.343 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -106.26 -179.23 3.88 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.839 0.855 . . . . 0.0 110.836 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -76.17 96.01 3.8 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.51 0.724 . . . . 0.0 109.618 -175.512 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.7 108.15 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.055 0.942 . . . . 0.0 110.519 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.7 t70 70.88 139.1 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.48 1.512 . . . . 0.0 112.72 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -139.76 27.29 2.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.586 0.754 . . . . 0.0 110.706 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -69.69 131.88 45.28 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.403 0.281 . . . . 0.0 111.577 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -117.29 110.35 17.98 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.516 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -71.72 157.81 37.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.492 0.663 . . . . 0.0 110.961 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.2 tp -84.81 121.78 74.5 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.242 -171.361 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.56 119.28 6.3 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 121.907 1.738 . . . . 0.0 110.751 172.561 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.69 -47.32 67.3 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 124.054 0.942 . . . . 0.0 112.093 -173.724 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -168.07 140.45 3.03 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.079 0.952 . . . . 0.0 109.448 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.36 24.91 4.71 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.619 0.723 . . . . 0.0 109.526 169.519 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -70.55 78.62 0.58 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.706 1.602 . . . . 0.0 110.143 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -81.36 91.07 6.21 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.755 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 m -122.76 154.13 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.64 1.176 . . . . 0.0 109.565 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -60.33 155.52 17.72 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.558 0.743 . . . . 0.0 111.111 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.443 ' HA ' HG23 ' A' ' 42' ' ' ILE . 48.3 p -51.44 -25.19 5.91 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.031 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -66.66 -25.71 66.7 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.422 0.63 . . . . 0.0 111.306 177.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.53 32.99 4.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.709 1.204 . . . . 0.0 110.469 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -50.03 -18.32 0.53 Allowed 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 124.593 1.157 . . . . 0.0 114.09 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.476 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.1 mt -126.4 -49.55 1.54 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.64 0.776 . . . . 0.0 109.715 170.535 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.08 -152.96 46.03 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-N 115.563 -0.744 . . . . 0.0 113.589 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.43 -17.0 21.47 Favored 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 122.682 2.255 . . . . 0.0 112.296 173.795 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -76.73 -38.78 53.66 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.192 0.997 . . . . 0.0 110.222 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.59 -0.24 70.97 Favored Glycine 0 C--N 1.347 1.178 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.953 -171.808 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.8 106.24 1.08 Allowed 'General case' 0 C--N 1.351 0.673 0 C-N-CA 124.427 1.091 . . . . 0.0 108.861 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.9 m -138.73 169.66 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.919 0.888 . . . . 0.0 110.034 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -91.76 109.02 20.72 Favored 'Isoleucine or valine' 0 C--O 1.243 0.756 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 164.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.443 HG23 ' HA ' ' A' ' 30' ' ' SER . 54.4 mt -61.12 132.41 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.033 0.933 . . . . 0.0 109.694 174.344 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -116.73 120.8 39.71 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 174.317 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -160.85 118.26 2.39 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.487 0.315 . . . . 0.0 111.269 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 t30 55.65 51.1 13.1 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.178 1.391 . . . . 0.0 111.68 171.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.43 -18.89 12.29 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.317 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -105.39 144.08 32.67 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.52 0.728 . . . . 0.0 110.232 -173.674 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.422 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.0 pt-20 -134.43 138.42 44.78 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.922 0.489 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -151.56 136.2 17.06 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.121 0.968 . . . . 0.0 110.236 -172.444 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.82 113.31 13.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.707 0.803 . . . . 0.0 109.957 -178.376 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.406 HD22 HD11 ' A' ' 42' ' ' ILE . 56.9 tp -104.29 138.8 40.21 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 169.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -141.29 146.66 37.06 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 111.058 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.4 mtpm? -78.64 107.64 11.46 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 167.294 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.7 p -67.33 130.07 41.89 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.734 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.44 -20.07 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 123.852 0.72 . . . . 0.0 111.148 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.44 -24.57 63.64 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.994 0.918 . . . . 0.0 111.187 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.03 43.03 0.88 Allowed Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.492 173.244 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -144.62 -174.39 4.31 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.102 0.561 . . . . 0.0 110.486 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.8 mt -116.07 142.93 46.15 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.669 1.188 . . . . 0.0 108.739 169.706 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -126.74 107.23 9.97 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -90.89 125.92 35.9 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 173.327 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -141.39 167.74 21.43 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.154 1.382 . . . . 0.0 108.491 -176.991 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? . . . . . 0 C--O 1.25 1.09 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 172.136 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.5 t -155.81 154.87 32.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.776 1.23 . . . . 0.0 108.674 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.75 -15.86 24.77 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.214 0.606 . . . . 0.0 109.609 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mpt? 65.0 166.7 0.17 Allowed 'General case' 0 C--N 1.362 1.133 0 C-N-CA 125.307 1.443 . . . . 0.0 112.197 -178.46 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -128.85 151.23 49.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.064 178.839 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -160.53 146.14 14.87 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -77.48 147.73 35.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.915 0.486 . . . . 0.0 110.545 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -100.56 170.41 8.39 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.454 0.702 . . . . 0.0 110.665 -177.472 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.26 152.6 81.78 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.382 1.073 . . . . 0.0 110.242 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.11 174.27 13.09 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.944 2.43 . . . . 0.0 113.267 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -67.29 142.41 96.73 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 123.889 0.876 . . . . 0.0 110.721 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -62.32 138.06 69.28 Favored 'Trans proline' 0 C--N 1.378 2.112 0 C-N-CA 122.809 2.34 . . . . 0.0 111.995 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -81.23 150.17 28.72 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.563 0.745 . . . . 0.0 111.139 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 144.27 47.41 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.308 0.643 . . . . 0.0 110.02 177.719 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 52.5 mt -99.22 -34.64 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.874 0.47 . . . . 0.0 111.862 -172.578 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -54.98 136.47 47.62 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -173.592 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.34 27.74 0.66 Allowed 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -120.59 -30.4 4.52 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.912 -166.644 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 75.7 p -79.45 66.74 5.0 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 121.961 0.886 . . . . 0.0 110.961 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.2 mt -88.38 169.34 11.89 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 124.192 0.997 . . . . 0.0 109.459 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.67 142.14 98.11 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 122.865 0.466 . . . . 0.0 110.473 -179.332 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -54.52 165.1 2.55 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.428 2.752 . . . . 0.0 113.371 177.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.3 -34.54 73.93 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.08 0.467 . . . . 0.0 111.031 175.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.59 173.54 14.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.879 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.34 38.57 1.55 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 122.012 0.91 . . . . 0.0 109.454 172.295 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.0 ttt180 -82.33 95.75 7.71 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.939 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.78 95.01 3.94 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 m -131.36 158.2 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.03 0.932 . . . . 0.0 109.342 175.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 11.1 m120 -62.09 158.58 16.34 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.134 0.897 . . . . 0.0 110.913 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.5 t -54.12 -22.39 10.97 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.713 1.205 . . . . 0.0 113.813 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -58.39 -38.87 78.22 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.099 0.56 . . . . 0.0 110.915 175.538 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.03 36.37 2.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.981 0.913 . . . . 0.0 110.596 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.03 -24.12 6.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 124.553 1.141 . . . . 0.0 113.948 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -130.33 -69.52 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.107 0.563 . . . . 0.0 109.653 174.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.26 -161.6 50.15 Favored Glycine 0 CA--C 1.533 1.179 0 O-C-N 123.996 0.81 . . . . 0.0 112.071 -172.478 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.93 -11.83 31.39 Favored 'Trans proline' 0 C--N 1.37 1.706 0 C-N-CA 122.759 2.306 . . . . 0.0 112.448 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.39 -49.95 61.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.146 0.978 . . . . 0.0 109.662 174.818 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.47 3.58 78.15 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.877 -1.056 . . . . 0.0 113.36 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -161.62 110.46 1.52 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.239 1.016 . . . . 0.0 108.29 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 m -147.08 167.53 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 123.013 0.525 . . . . 0.0 110.334 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.1 mt -90.54 108.03 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 166.811 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.32 135.25 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.634 1.174 . . . . 0.0 109.41 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -115.69 127.06 54.88 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 124.521 1.128 . . . . 0.0 108.472 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -165.79 123.37 1.48 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.846 0.858 . . . . 0.0 109.688 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 67.3 26.77 8.46 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.588 1.155 . . . . 0.0 110.725 173.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.84 16.24 79.38 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.121 -176.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -114.96 133.67 55.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.061 0.944 . . . . 0.0 108.833 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -116.55 133.22 56.27 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.122 0.969 . . . . 0.0 110.541 -174.031 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -140.7 125.26 17.86 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -79.64 106.05 11.39 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.417 ' HB3' HD11 ' A' ' 42' ' ' ILE . 59.9 tp -101.99 131.36 48.45 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -138.4 140.34 39.31 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 123.836 0.71 . . . . 0.0 110.306 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -84.63 112.16 20.2 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 173.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 9.6 p -74.53 148.22 41.09 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.72 -8.61 44.34 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 124.17 0.919 . . . . 0.0 112.692 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.9 -3.83 37.54 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.591 0.757 . . . . 0.0 111.505 169.748 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.89 38.91 7.75 Favored Glycine 0 C--N 1.353 1.504 0 C-N-CA 123.355 0.503 . . . . 0.0 112.12 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 22.8 mtpp -130.97 -178.48 4.84 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.155 0.582 . . . . 0.0 110.675 -174.12 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.7 mt -111.3 156.24 21.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.46 1.104 . . . . 0.0 109.39 169.281 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.3 tp -144.76 101.57 3.67 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 176.098 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -84.56 114.73 22.18 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 174.462 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.7 p -126.45 154.79 43.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.502 1.121 . . . . 0.0 108.565 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.921 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.408 0.147 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 m -60.54 117.12 4.91 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.735 0.814 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -95.25 145.93 24.71 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.466 0.706 . . . . 0.0 110.075 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 80.0 mtp -72.3 142.48 48.86 Favored 'General case' 0 C--O 1.242 0.659 0 O-C-N 124.01 0.819 . . . . 0.0 109.045 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.56 156.03 27.75 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.643 0.589 . . . . 0.0 111.563 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.47 153.7 34.64 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.163 0.585 . . . . 0.0 111.143 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.9 m -75.38 74.18 2.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.129 0.972 . . . . 0.0 111.792 -170.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 54.3 -171.32 0.05 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.145 1.378 . . . . 0.0 112.91 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 pp -75.59 159.71 80.96 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 169.248 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.95 130.11 25.01 Favored 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 121.583 1.522 . . . . 0.0 110.793 174.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -68.24 143.06 95.43 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 123.301 0.376 . . . . 0.0 110.124 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.62 156.08 38.98 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.753 2.302 . . . . 0.0 113.065 173.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -95.81 153.66 17.63 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 123.861 0.865 . . . . 0.0 109.564 178.28 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -61.42 113.26 2.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.447 0.699 . . . . 0.0 110.348 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 31.6 mt -91.24 103.81 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.364 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -82.34 -170.29 2.85 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 170.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -127.87 64.57 1.37 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 56.77 84.77 0.09 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.134 1.373 . . . . 0.0 111.744 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.9 m -65.62 134.01 52.37 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.136 -178.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -79.24 162.13 25.89 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.533 0.733 . . . . 0.0 110.432 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mp -109.1 145.49 31.86 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 123.843 0.857 . . . . 0.0 109.786 -177.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.8 144.77 60.46 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 122.414 2.076 . . . . 0.0 111.04 171.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.99 74.78 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.46 0.475 . . . . 0.0 110.179 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.01 117.54 1.21 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 123.848 0.717 . . . . 0.0 109.637 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.58 69.58 7.11 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.807 0.843 . . . . 0.0 109.196 173.597 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -125.67 88.73 2.91 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.594 0.758 . . . . 0.0 109.114 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.1 mtp85 -81.33 90.39 6.14 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.523 0.678 . . . . 0.0 110.375 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.5 m -121.34 157.73 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.758 1.223 . . . . 0.0 109.173 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -64.62 156.93 28.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.569 0.747 . . . . 0.0 110.148 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.8 t -56.41 -20.16 18.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.362 1.065 . . . . 0.0 113.787 -174.553 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -54.88 -40.85 70.18 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.771 0.828 . . . . 0.0 111.372 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.78 40.31 1.4 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.491 1.116 . . . . 0.0 110.347 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -48.08 -18.53 0.2 Allowed 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.57 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 86.0 mt -117.25 -33.49 4.64 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.538 0.608 . . . . 0.0 110.963 176.748 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.66 -145.61 45.68 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-O 118.939 -0.923 . . . . 0.0 112.465 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -88.1 -13.41 3.75 Favored 'Trans proline' 0 C--N 1.369 1.64 0 C-N-CA 122.98 2.453 . . . . 0.0 112.92 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -91.72 -29.15 16.98 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.591 0.757 . . . . 0.0 111.538 -173.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.57 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 86.11 0.67 86.99 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -165.101 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -146.46 119.74 8.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.729 1.212 . . . . 0.0 109.197 -176.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.437 HG23 HD12 ' A' ' 42' ' ' ILE . 35.7 m -151.1 171.6 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.137 0.975 . . . . 0.0 109.601 178.135 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 62.1 mt -91.35 106.54 17.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 168.805 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.437 HD12 HG23 ' A' ' 40' ' ' VAL . 1.6 mp -68.48 137.08 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 124.726 1.21 . . . . 0.0 109.926 176.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -112.4 126.57 55.43 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 169.882 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -164.47 140.68 6.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 173.731 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 66.55 14.76 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.097 1.359 . . . . 0.0 111.442 -175.688 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.29 -5.38 72.84 Favored Glycine 0 C--N 1.352 1.459 0 C-N-CA 123.329 0.49 . . . . 0.0 112.8 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -95.76 161.46 14.01 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.408 1.083 . . . . 0.0 109.782 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.45 138.52 54.01 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.333 0.653 . . . . 0.0 110.14 -178.011 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 140.21 26.16 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.04 122.72 30.46 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -114.07 135.1 54.39 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 167.222 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -138.86 137.8 36.88 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.505 0.503 . . . . 0.0 111.094 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.562 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -79.01 102.38 8.31 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 169.951 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.3 p -65.74 140.28 58.43 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -75.44 -0.59 20.57 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.126 0.489 . . . . 0.0 111.676 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.93 -1.51 22.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.895 0.878 . . . . 0.0 111.236 163.804 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.32 35.57 8.68 Favored Glycine 0 C--N 1.35 1.356 0 C-N-CA 124.018 0.818 . . . . 0.0 112.571 174.337 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -133.96 173.85 11.12 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.667 0.387 . . . . 0.0 111.362 -174.413 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.473 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.6 mt -110.15 136.18 49.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.939 1.295 . . . . 0.0 109.274 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.33 98.7 5.55 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -92.8 104.67 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -115.28 126.78 54.91 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.613 1.165 . . . . 0.0 108.88 175.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.909 -175.972 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -91.56 98.57 11.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.099 0.56 . . . . 0.0 109.87 -177.976 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -120.41 -77.66 0.58 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.982 0.913 . . . . 0.0 109.346 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.1 ttt -88.28 87.03 7.17 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.86 77.88 7.7 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -84.43 154.4 22.8 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.968 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 48.1 m -71.96 137.13 47.09 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -59.82 145.08 46.79 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.787 0.835 . . . . 0.0 110.25 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.19 112.77 9.94 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.044 0.938 . . . . 0.0 109.643 178.812 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -56.65 127.29 25.28 Favored 'Trans proline' 0 C--N 1.382 2.331 0 C-N-CA 122.926 2.417 . . . . 0.0 112.313 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -61.29 142.55 93.51 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.417 0.687 . . . . 0.0 109.908 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -58.97 111.9 1.04 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.665 2.243 . . . . 0.0 110.631 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -59.84 98.66 0.06 Allowed 'General case' 0 C--N 1.358 0.965 0 O-C-N 124.007 0.817 . . . . 0.0 110.622 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.8 135.64 33.3 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.959 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -109.47 99.32 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.618 0.767 . . . . 0.0 109.187 178.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -158.04 109.93 2.29 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -80.22 103.01 9.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.489 0.716 . . . . 0.0 110.568 -177.312 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -95.75 -3.74 45.29 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.749 0.82 . . . . 0.0 110.756 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.1 p -64.54 148.04 51.58 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.879 0.872 . . . . 0.0 110.99 174.363 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.3 mt -73.98 153.35 39.78 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.332 0.653 . . . . 0.0 111.264 -174.784 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.81 141.72 33.86 Favored Pre-proline 0 N--CA 1.477 0.921 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.715 -173.702 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.62 150.62 63.25 Favored 'Trans proline' 0 C--N 1.386 2.501 0 C-N-CA 122.69 2.26 . . . . 0.0 111.932 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.596 ' HB3' HD11 ' A' ' 50' ' ' LEU . . . -72.63 -42.32 64.56 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.756 0.423 . . . . 0.0 111.819 -176.648 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.09 163.97 28.34 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.208 0.603 . . . . 0.0 110.735 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.02 24.58 8.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 110.13 172.276 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -81.28 93.71 6.59 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.919 0.487 . . . . 0.0 110.874 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 102.46 4.43 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.3 m -123.32 157.61 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.705 1.202 . . . . 0.0 108.136 168.999 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 7.1 p30 -74.03 167.05 22.3 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 122.941 0.151 . . . . 0.0 110.675 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -48.56 -30.94 5.81 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -172.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -62.81 -31.86 72.93 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 118.503 0.592 . . . . 0.0 111.197 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.86 30.07 5.39 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.391 1.077 . . . . 0.0 110.202 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.6 pt? -48.94 -29.33 4.64 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.523 1.129 . . . . 0.0 113.833 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 93.3 mt -130.97 -69.92 0.62 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 109.735 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.9 -151.66 52.12 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.932 -174.0 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.27 -13.66 25.59 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 122.523 2.148 . . . . 0.0 112.437 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.7 -60.49 2.21 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.167 0.987 . . . . 0.0 110.397 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.72 -17.33 45.73 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-N 114.822 -1.081 . . . . 0.0 113.178 -175.937 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -136.45 99.38 4.07 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.654 0.782 . . . . 0.0 110.108 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.69 165.3 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 124.02 0.928 . . . . 0.0 109.468 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.416 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 54.6 mt -90.19 118.54 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.257 0.623 . . . . 0.0 109.666 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 mp -78.56 131.09 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.972 1.309 . . . . 0.0 110.009 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.5 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 12.2 t70 -104.13 122.29 45.01 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 124.894 1.277 . . . . 0.0 107.781 171.35 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -156.98 110.53 2.61 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.31 0.644 . . . . 0.0 109.366 -175.46 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 10.4 m120 61.65 28.25 17.46 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.155 0.982 . . . . 0.0 111.375 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.54 -9.35 76.15 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.862 -0.608 . . . . 0.0 113.464 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -81.18 138.38 35.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.445 0.698 . . . . 0.0 109.972 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.45 124.75 52.91 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.879 0.871 . . . . 0.0 108.69 177.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.479 ' HD2' HD21 ' A' ' 61' ' ' LEU . 8.7 p90 -152.6 125.07 8.23 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.81 0.444 . . . . 0.0 112.054 177.952 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.596 HD11 ' HB3' ' A' ' 23' ' ' ALA . 3.2 tm? -77.93 115.54 17.74 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.611 1.165 . . . . 0.0 109.455 -173.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.441 HD11 ' HB3' ' A' ' 59' ' ' LEU . 36.0 tp -104.56 131.17 52.28 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 171.893 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' ' 60' ' ' LEU . 15.7 ptm180 -134.52 134.31 41.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.043 0.839 . . . . 0.0 110.688 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.458 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.8 mtpm? -82.74 103.9 12.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.481 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.2 p -64.93 144.01 57.57 Favored 'General case' 0 C--O 1.253 1.254 0 O-C-N 123.968 0.793 . . . . 0.0 109.362 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -68.87 -11.63 60.73 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.358 1.063 . . . . 0.0 112.146 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.93 -0.87 17.47 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.933 0.893 . . . . 0.0 111.431 169.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.96 44.53 7.62 Favored Glycine 0 C--N 1.354 1.53 0 C-N-CA 123.585 0.612 . . . . 0.0 112.2 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -139.39 174.97 9.97 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 122.555 0.342 . . . . 0.0 110.748 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' HB3' HD11 ' A' ' 51' ' ' LEU . 80.9 mt -109.14 135.27 50.55 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.351 1.061 . . . . 0.0 109.957 171.919 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' HD3' ' A' ' 52' ' ' ARG . 14.6 tp -125.0 106.34 9.88 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LEU . . . . . 0.479 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.4 tm? -89.13 100.95 13.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 67.3 p -108.91 159.76 16.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 C--O 1.252 1.191 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.981 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mmm . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.7 t -89.49 108.01 19.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -144.75 8.46 1.29 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.497 0.719 . . . . 0.0 111.197 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.82 114.19 28.19 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.061 0.944 . . . . 0.0 109.307 177.637 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -100.72 -5.67 26.13 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.424 0.69 . . . . 0.0 110.738 174.67 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -78.92 149.71 32.31 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.297 0.639 . . . . 0.0 109.368 171.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.5 m -79.11 91.47 4.92 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -71.99 132.53 44.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.281 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.5 mt -86.07 114.65 58.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 123.232 0.613 . . . . 0.0 109.749 -173.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.19 123.79 14.68 Favored 'Trans proline' 0 C--N 1.385 2.476 0 C-N-CA 123.458 2.772 . . . . 0.0 113.362 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 -116.59 89.6 28.3 Favored Pre-proline 0 CA--C 1.56 1.353 0 C-N-CA 123.301 0.641 . . . . 0.0 110.27 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.68 130.35 3.19 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 122.742 2.294 . . . . 0.0 112.345 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -146.77 142.23 27.54 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 122.939 0.496 . . . . 0.0 110.494 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -66.7 107.7 2.23 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.287 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.22 83.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.243 0.617 . . . . 0.0 109.762 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -168.76 108.7 0.49 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 107.509 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.69 34.76 4.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 44.7 32.8 0.83 Allowed 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 125.956 1.702 . . . . 0.0 112.786 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.6 m -64.44 128.53 36.18 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.116 0.966 . . . . 0.0 111.179 -173.475 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.8 -173.84 2.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.967 0.907 . . . . 0.0 111.845 -177.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.6 mp -59.22 138.79 88.37 Favored Pre-proline 0 CA--C 1.556 1.175 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.31 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.466 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 1.6 Cg_endo -40.72 -55.36 2.01 Favored 'Trans proline' 0 C--N 1.391 2.766 0 C-N-CA 124.654 3.569 . . . . 0.0 113.09 -177.311 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . 175.75 -60.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 173.788 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -153.2 143.25 22.24 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.208 -1.36 . . . . 0.0 109.262 172.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -86.3 30.96 0.67 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.467 0.707 . . . . 0.0 111.571 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.461 ' HG3' HG13 ' A' ' 28' ' ' VAL . 7.8 tpp180 -87.96 92.87 9.29 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.097 0.559 . . . . 0.0 109.616 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -79.72 103.76 9.84 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.189 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.461 HG13 ' HG3' ' A' ' 26' ' ' ARG . 20.8 m -110.88 154.1 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.617 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -52.44 150.13 5.13 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.481 0.712 . . . . 0.0 111.02 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.539 ' HA ' HG23 ' A' ' 42' ' ' ILE . 15.5 m -47.24 -35.17 7.32 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -58.09 -32.32 67.96 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.902 0.881 . . . . 0.0 112.202 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.66 31.23 4.86 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.284 1.034 . . . . 0.0 111.75 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -46.2 -22.83 0.27 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -178.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -125.31 -68.9 0.81 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.472 0.709 . . . . 0.0 109.923 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.78 -153.59 51.54 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 113.457 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -70.5 -16.65 34.46 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.983 2.456 . . . . 0.0 112.247 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.56 -56.64 3.75 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.834 0.854 . . . . 0.0 110.167 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.9 -10.01 64.12 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-N 114.799 -1.091 . . . . 0.0 113.397 -175.538 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -136.41 73.53 1.46 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.198 0.999 . . . . 0.0 110.708 -175.826 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 19.6 m -135.88 161.15 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.008 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 35.1 mt -86.83 121.79 38.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.08 -178.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 51' ' ' LEU . 48.8 mt -69.6 105.9 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.798 0.839 . . . . 0.0 109.39 173.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -87.16 121.52 29.73 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 172.653 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -147.46 95.71 2.58 Favored 'General case' 0 C--O 1.241 0.658 0 O-C-N 123.869 0.731 . . . . 0.0 110.035 -175.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 23.6 m120 58.42 45.15 17.13 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.422 1.089 . . . . 0.0 112.034 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.84 -26.41 6.02 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 113.709 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.71 107.7 15.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -101.42 138.56 38.27 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.641 0.776 . . . . 0.0 109.675 178.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.605 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -147.69 126.43 12.61 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.544 0.737 . . . . 0.0 109.035 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 2.9 tm? -71.71 126.14 28.94 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.115 0.566 . . . . 0.0 110.382 -174.458 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.0 tp -117.15 119.74 36.15 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 172.093 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.9 ptm180 -126.6 136.27 52.31 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.944 0.402 . . . . 0.0 110.616 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -76.36 99.6 4.88 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.5 p -64.39 138.2 58.29 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -72.38 -7.11 47.95 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 124.764 1.29 . . . . 0.0 111.341 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.76 -18.76 62.76 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.888 0.875 . . . . 0.0 111.088 168.28 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.89 38.33 2.2 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.984 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -140.78 176.75 8.54 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.305 0.574 . . . . 0.0 111.428 -174.727 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.1 mt -108.15 136.58 47.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 109.133 169.543 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -119.34 103.69 9.71 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -91.42 124.75 35.84 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.6 p -136.72 120.54 17.43 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.1 0.96 . . . . 0.0 108.981 -174.385 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HD3' ' HB3' ' A' ' 49' ' ' TYR . 35.1 mmtp . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.021 0.928 . . . . 0.0 109.819 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.408 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.483 1.224 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.7 p -85.02 78.15 9.96 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.629 0.772 . . . . 0.0 111.087 -174.707 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.15 79.8 1.3 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 170.058 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 ptp -104.96 97.8 7.61 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.957 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -87.37 100.33 12.65 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.151 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.22 149.0 48.82 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.444 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -154.29 154.81 34.03 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 123.388 0.675 . . . . 0.0 109.843 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -97.73 153.68 18.09 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.268 1.027 . . . . 0.0 109.269 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -76.44 153.93 83.88 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 122.82 0.448 . . . . 0.0 111.444 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -56.12 132.3 51.1 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.926 2.417 . . . . 0.0 112.108 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -96.69 161.47 26.49 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 123.936 0.895 . . . . 0.0 110.459 -177.577 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -48.93 146.8 11.27 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.317 2.678 . . . . 0.0 113.837 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -73.22 160.32 32.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.408 0.683 . . . . 0.0 112.303 -175.12 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.48 141.04 35.59 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.357 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.9 mt -128.1 99.86 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -132.21 70.14 1.47 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -91.79 96.96 10.7 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.216 -177.673 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -137.62 15.61 2.93 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 124.162 0.985 . . . . 0.0 110.157 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 25.1 p -75.89 100.31 4.77 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.517 0.727 . . . . 0.0 110.936 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -91.74 161.97 14.66 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.775 0.83 . . . . 0.0 110.283 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.2 mt -106.47 139.98 20.86 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.597 0.759 . . . . 0.0 110.267 -176.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.93 161.12 23.05 Favored 'Trans proline' 0 C--N 1.383 2.39 0 C-N-CA 123.071 2.514 . . . . 0.0 112.617 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -56.85 -56.91 15.5 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.752 0.821 . . . . 0.0 112.672 -172.975 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -166.01 114.67 0.95 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.12 0.568 . . . . 0.0 110.76 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.17 100.23 4.22 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-O 121.992 0.901 . . . . 0.0 109.442 175.043 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -150.61 91.22 1.71 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 108.865 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.74 86.78 3.36 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.447 -176.297 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.8 m -101.33 167.58 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.451 1.1 . . . . 0.0 108.048 172.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -55.01 149.22 12.19 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.589 0.756 . . . . 0.0 111.343 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 t -58.71 -26.12 63.59 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.33 0.652 . . . . 0.0 111.609 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -60.49 -35.72 76.61 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.757 0.823 . . . . 0.0 110.983 172.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.54 30.54 3.54 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.193 0.997 . . . . 0.0 110.972 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -47.03 -28.44 1.68 Allowed 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.918 1.287 . . . . 0.0 114.324 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 88.7 mt -121.37 -56.12 1.91 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.499 0.72 . . . . 0.0 109.376 175.419 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.25 -151.75 50.23 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.333 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.86 -13.13 14.51 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.535 2.157 . . . . 0.0 112.496 172.681 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.58 -43.44 15.67 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.672 0.789 . . . . 0.0 110.488 -177.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 79.0 4.32 88.66 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.449 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 17.3 ptpt -151.59 75.23 1.16 Allowed 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.756 0.789 . . . . 0.0 110.387 -173.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -141.46 169.6 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.124 -175.331 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 48' ' ' GLU . 23.0 mt -91.59 125.08 44.32 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 CA-C-O 121.499 0.666 . . . . 0.0 110.9 -178.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -62.96 134.8 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.839 1.656 . . . . 0.0 109.464 168.57 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -114.72 115.52 27.21 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 163.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -126.73 87.23 2.62 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.1 t30 66.66 22.43 10.44 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 124.617 1.167 . . . . 0.0 110.766 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.57 -4.99 56.79 Favored Glycine 0 C--N 1.351 1.416 0 O-C-N 121.772 -0.58 . . . . 0.0 113.333 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -81.55 108.08 14.83 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.597 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 9.8 pt-20 -98.25 135.21 40.21 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.477 0.486 . . . . 0.0 111.303 -174.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -145.71 125.9 13.82 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 123.555 0.742 . . . . 0.0 110.021 175.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -78.91 103.18 8.68 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.565 0.62 . . . . 0.0 109.55 176.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.0 tp -96.72 132.33 42.51 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 17.1 ptm180 -138.7 137.75 37.09 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 123.54 0.525 . . . . 0.0 111.214 -175.247 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -81.47 99.23 8.64 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.431 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 17.1 p -67.7 142.47 56.31 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 123.899 0.749 . . . . 0.0 109.412 -177.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -64.01 -16.35 61.43 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 124.877 1.361 . . . . 0.0 112.004 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.08 -7.63 31.06 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.174 0.99 . . . . 0.0 112.459 171.452 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.02 42.66 5.9 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.687 0.661 . . . . 0.0 112.007 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.8 mtpt -140.98 177.84 7.78 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.092 0.557 . . . . 0.0 110.479 -172.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.2 mt -114.24 143.61 44.57 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.646 1.178 . . . . 0.0 109.198 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.537 ' HG ' HG23 ' A' ' 62' ' ' THR . 17.9 tp -132.98 105.32 7.01 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.692 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -89.61 102.11 14.79 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' THR . . . . . 0.537 HG23 ' HG ' ' A' ' 60' ' ' LEU . 25.6 p -129.14 123.13 31.34 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.9 0.88 . . . . 0.0 109.913 -175.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 48' ' ' GLU . 24.1 tptp . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptp . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 t -164.14 -64.71 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.851 0.86 . . . . 0.0 109.004 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -98.22 -71.67 0.68 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.987 0.915 . . . . 0.0 109.88 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.9 mmt -137.92 164.7 28.35 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.661 1.184 . . . . 0.0 109.468 -174.921 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -78.35 135.85 37.56 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.312 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -80.75 94.45 6.4 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.17 0.588 . . . . 0.0 110.409 -174.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -161.54 152.64 18.36 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.33 0.652 . . . . 0.0 109.842 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -135.96 152.83 51.37 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.308 1.043 . . . . 0.0 109.246 177.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.62 124.37 90.83 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 122.944 0.497 . . . . 0.0 109.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.72 145.41 63.17 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.632 2.221 . . . . 0.0 112.604 -175.247 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -75.56 119.9 79.19 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.46 0.704 . . . . 0.0 109.538 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.44 138.33 38.57 Favored 'Trans proline' 0 C--N 1.372 1.803 0 C-N-CA 122.617 2.211 . . . . 0.0 111.739 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.63 120.08 13.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.133 0.573 . . . . 0.0 110.776 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.3 132.29 34.64 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 169.333 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 63.4 mt -79.81 120.47 31.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.458 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -134.12 95.01 3.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.34 1.056 . . . . 0.0 108.793 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -76.56 -8.12 56.57 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.931 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -65.49 132.84 49.92 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.841 1.256 . . . . 0.0 110.026 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t -140.41 160.96 38.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.645 0.778 . . . . 0.0 109.641 -178.428 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.7 mt -85.69 148.39 25.91 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.821 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp -125.82 86.01 58.29 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.967 0.907 . . . . 0.0 109.135 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.45 -69.47 0.03 OUTLIER 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.18 1.92 . . . . 0.0 110.643 170.123 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . 167.32 -58.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 126.53 1.932 . . . . 0.0 106.813 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.44 118.15 1.91 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.72 1.208 . . . . 0.0 108.518 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -71.05 90.39 0.84 Allowed 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.149 0.58 . . . . 0.0 109.587 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -139.01 84.2 2.0 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.09 0.956 . . . . 0.0 108.883 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -75.94 86.18 2.87 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.341 0.591 . . . . 0.0 110.24 -177.664 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -109.93 149.11 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 124.468 1.107 . . . . 0.0 108.216 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -51.83 157.87 1.12 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.591 1.156 . . . . 0.0 112.702 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -54.05 -28.05 36.27 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.209 1.004 . . . . 0.0 113.301 179.491 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -62.12 -34.98 77.36 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.999 0.428 . . . . 0.0 110.654 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.4 35.59 2.08 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.589 1.156 . . . . 0.0 110.695 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -47.71 -21.53 0.39 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.9 mt -130.49 -43.3 1.14 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.256 0.623 . . . . 0.0 109.917 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.63 -158.6 51.21 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.62 -175.667 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.95 -14.47 15.33 Favored 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 169.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -79.2 -35.42 41.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.878 0.871 . . . . 0.0 111.077 -174.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.0 -11.13 63.35 Favored Glycine 0 C--N 1.352 1.453 0 N-CA-C 114.665 0.626 . . . . 0.0 114.665 171.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -149.58 85.9 1.45 Allowed 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.054 0.927 . . . . 0.0 110.183 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -131.58 171.32 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.393 0.677 . . . . 0.0 110.462 -171.512 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.421 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 32.9 mt -99.91 123.22 52.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 123.183 0.593 . . . . 0.0 109.805 176.868 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -73.55 122.7 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 124.896 1.279 . . . . 0.0 109.011 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -93.59 123.03 36.64 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.279 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -148.63 96.71 2.63 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.706 0.802 . . . . 0.0 109.959 -177.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 2.7 m-20 59.15 30.94 20.83 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.576 1.151 . . . . 0.0 112.15 172.074 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.11 -22.3 39.89 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-O 119.698 -0.501 . . . . 0.0 113.397 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -83.6 153.53 24.26 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.8 pt-20 -133.92 135.3 43.5 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.166 0.291 . . . . 0.0 110.617 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -135.52 113.9 11.56 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -70.21 110.59 5.29 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 175.305 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.403 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.4 tp -106.56 118.62 37.13 Favored 'General case' 0 C--O 1.249 1.041 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.485 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.6 ptm180 -123.6 137.05 54.82 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.979 0.512 . . . . 0.0 110.76 -177.794 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -78.47 99.32 6.39 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -69.58 142.84 53.48 Favored 'General case' 0 C--O 1.251 1.174 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -69.44 -10.3 57.39 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.105 0.962 . . . . 0.0 111.602 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.61 -24.41 67.56 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.572 0.749 . . . . 0.0 110.948 167.08 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.94 37.53 2.71 Favored Glycine 0 C--N 1.35 1.307 0 C-N-CA 124.358 0.98 . . . . 0.0 111.733 -179.559 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.9 mtpt -135.02 176.04 9.03 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.444 0.64 . . . . 0.0 111.524 -172.641 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.403 ' HB3' HD11 ' A' ' 51' ' ' LEU . 49.8 mt -109.58 141.71 41.69 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.035 -1.438 . . . . 0.0 107.405 163.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 tp -131.5 103.08 6.21 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -88.54 113.19 23.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 p -137.63 142.03 41.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.534 1.134 . . . . 0.0 108.884 -175.485 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 122.972 0.509 . . . . 0.0 109.653 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtm . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t 50.6 76.81 0.14 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.248 1.419 . . . . 0.0 112.86 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -84.44 -57.44 3.15 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.886 0.474 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.1 ttt 66.1 126.81 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.11 1.364 . . . . 0.0 112.748 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.12 132.53 36.6 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -115.52 111.44 20.73 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.597 0.759 . . . . 0.0 109.285 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -68.2 146.76 53.08 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 175.314 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -120.25 157.22 29.6 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 122.821 0.448 . . . . 0.0 111.916 -167.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -64.66 154.67 84.38 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.54 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -53.91 101.56 0.07 OUTLIER 'Trans proline' 0 C--N 1.384 2.44 0 C-N-CA 123.36 2.706 . . . . 0.0 112.507 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -81.81 144.63 52.29 Favored Pre-proline 0 N--CA 1.473 0.712 0 C-N-CA 123.298 0.639 . . . . 0.0 110.515 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.23 164.86 21.69 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.205 1.937 . . . . 0.0 111.804 171.518 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -155.7 106.56 2.5 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 123.541 0.736 . . . . 0.0 109.256 177.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 66.31 100.87 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.201 1.4 . . . . 0.0 111.182 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 61.9 mt -83.18 122.21 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.92 0.888 . . . . 0.0 111.298 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t70 73.91 153.06 0.14 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 125.012 1.325 . . . . 0.0 113.472 167.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -96.5 23.58 6.7 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.143 0.977 . . . . 0.0 112.135 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -57.13 135.79 56.38 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.459 0.704 . . . . 0.0 112.059 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 m -116.53 104.0 10.97 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.15 157.7 32.5 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.878 0.471 . . . . 0.0 110.445 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.1 mt -76.59 151.32 82.73 Favored Pre-proline 0 CA--C 1.545 0.788 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.076 -177.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.84 156.15 24.63 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 123.007 2.471 . . . . 0.0 112.626 170.201 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.01 -21.63 32.22 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 123.898 0.879 . . . . 0.0 112.999 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.99 161.1 41.48 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.402 1.081 . . . . 0.0 108.933 171.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -111.07 29.59 7.65 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.894 0.854 . . . . 0.0 109.238 168.886 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -82.25 86.23 6.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.778 0.831 . . . . 0.0 109.947 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -77.15 87.5 3.61 Favored 'General case' 0 C--N 1.36 1.023 0 CA-C-O 121.091 0.472 . . . . 0.0 110.185 177.949 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.5 m -101.86 154.35 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 173.501 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -58.6 150.55 22.78 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.097 0.559 . . . . 0.0 109.764 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 p -51.04 -25.05 4.33 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -175.698 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -56.29 -38.73 71.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.82 0.848 . . . . 0.0 111.506 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.37 36.29 2.19 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.969 0.908 . . . . 0.0 110.777 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -46.39 -26.26 0.8 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.558 1.543 . . . . 0.0 115.029 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 97.5 mt -127.38 -54.34 1.36 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 122.824 0.45 . . . . 0.0 110.089 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 -158.46 53.39 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.488 -175.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -78.21 -7.55 16.16 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.372 2.048 . . . . 0.0 112.031 172.47 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.92 -48.35 13.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.459 1.104 . . . . 0.0 110.467 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.22 -12.9 61.16 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.898 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -142.9 89.46 2.12 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 117.579 0.69 . . . . 0.0 110.761 -177.791 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.3 m -140.56 163.01 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 123.213 0.605 . . . . 0.0 110.363 -175.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 25.7 mt -88.49 125.41 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -81.15 119.57 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.246 1.419 . . . . 0.0 109.329 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -103.19 115.4 30.5 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.059 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -161.99 142.07 10.15 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.158 0.983 . . . . 0.0 108.729 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.5 m120 70.18 12.61 7.69 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.554 1.542 . . . . 0.0 111.611 -177.72 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.0 83.09 Favored Glycine 0 C--N 1.345 1.034 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 -170.738 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.5 mt-30 -111.15 158.05 19.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.348 1.059 . . . . 0.0 108.683 178.064 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.74 125.86 27.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 122.811 0.444 . . . . 0.0 110.435 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -148.5 126.78 12.21 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 111.273 -174.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.527 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 3.3 tm? -75.29 122.74 24.17 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.855 1.262 . . . . 0.0 110.722 -172.602 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' A' ' 59' ' ' LEU . 54.9 tp -111.29 127.04 55.5 Favored 'General case' 0 C--O 1.245 0.866 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 167.952 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.448 ' HD3' HD23 ' A' ' 60' ' ' LEU . 16.9 ptm180 -128.24 142.93 51.02 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.71 0.631 . . . . 0.0 110.564 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.42 ' HD2' HD13 ' A' ' 34' ' ' LEU . 27.5 mtpp -83.59 104.88 14.07 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.717 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.2 p -71.4 134.23 46.5 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 172.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -72.98 -0.64 14.33 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.964 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.15 -14.21 61.76 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.953 0.901 . . . . 0.0 110.715 166.891 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.82 35.15 4.11 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.501 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -139.42 173.52 11.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.006 0.523 . . . . 0.0 111.289 -174.376 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 51' ' ' LEU . 59.7 mt -111.26 144.42 40.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.301 1.04 . . . . 0.0 109.242 174.725 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LEU . . . . . 0.448 HD23 ' HD3' ' A' ' 52' ' ' ARG . 16.3 tp -132.47 113.83 13.58 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -177.263 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.76 124.52 35.95 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.485 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 80.9 p -142.39 -169.59 3.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.155 1.782 . . . . 0.0 106.534 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HA ' ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 121.548 -0.72 . . . . 0.0 110.577 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.7 m -68.3 -66.4 0.57 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.003 0.521 . . . . 0.0 110.723 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? 62.68 -80.56 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.906 1.282 . . . . 0.0 109.435 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 65.2 mtt -139.6 107.75 5.76 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 170.351 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.66 -57.04 14.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.612 0.765 . . . . 0.0 111.986 -177.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.1 t30 66.09 136.31 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.574 1.549 . . . . 0.0 112.454 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.7 t -141.6 151.19 42.93 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 123.642 0.777 . . . . 0.0 109.477 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -108.89 139.55 43.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.817 0.847 . . . . 0.0 109.816 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.8 mp -81.26 129.02 68.37 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.211 0.604 . . . . 0.0 109.869 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.64 150.31 70.72 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.941 2.427 . . . . 0.0 112.918 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -86.78 148.5 46.03 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 122.878 0.471 . . . . 0.0 110.882 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.86 178.97 3.52 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 0.0 112.331 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 141.6 58.1 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.502 0.721 . . . . 0.0 111.811 -177.701 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 126.65 28.4 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.525 0.73 . . . . 0.0 110.836 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.2 mt -114.53 109.06 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.381 0.672 . . . . 0.0 109.424 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -82.75 147.96 28.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.251 171.473 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -91.23 33.83 0.96 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.566 0.746 . . . . 0.0 111.146 178.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 63.81 98.99 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 125.722 1.609 . . . . 0.0 112.249 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 t -70.79 125.33 26.52 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 121.061 0.458 . . . . 0.0 109.967 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.6 mt -92.24 172.99 8.05 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.478 0.711 . . . . 0.0 109.818 178.204 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.56 153.21 93.69 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.62 0.768 . . . . 0.0 111.572 -177.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -52.02 150.21 19.14 Favored 'Trans proline' 0 C--N 1.386 2.503 0 C-N-CA 123.253 2.636 . . . . 0.0 112.961 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB1' ' HD3' ' A' ' 39' ' ' LYS . . . -57.15 -44.37 83.34 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.275 0.63 . . . . 0.0 111.587 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 39' ' ' LYS . . . -164.58 118.8 1.37 Allowed 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.748 0.819 . . . . 0.0 109.606 172.262 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -77.83 85.52 4.1 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 122.036 0.922 . . . . 0.0 109.789 177.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.401 ' HG3' HG13 ' A' ' 28' ' ' VAL . 19.7 tpp180 -137.47 90.08 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.719 -178.526 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -74.85 89.66 2.35 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.529 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.401 HG13 ' HG3' ' A' ' 26' ' ' ARG . 23.5 m -112.61 161.11 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.006 1.323 . . . . 0.0 109.214 172.699 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.439 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 58.5 t30 -69.66 160.62 31.25 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.401 0.68 . . . . 0.0 109.972 175.351 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.5 m -50.04 -27.56 5.74 Favored 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 124.45 1.1 . . . . 0.0 113.89 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -57.27 -34.59 68.81 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.59 0.756 . . . . 0.0 111.694 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.59 40.83 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.106 0.962 . . . . 0.0 110.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -50.56 -20.25 1.12 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -132.21 -54.2 0.97 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.301 0.64 . . . . 0.0 109.317 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.79 -144.46 45.28 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.974 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -79.85 -12.48 13.43 Favored 'Trans proline' 0 C--N 1.376 2.016 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.95 -42.9 13.65 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.572 -174.992 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.69 3.07 86.8 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.697 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HD3' ' HB1' ' A' ' 23' ' ' ALA . 8.4 ptpp? -160.58 109.82 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.2 m -148.57 174.92 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 123.701 0.8 . . . . 0.0 111.011 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ILE . . . . . 0.404 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 58.8 mt -98.63 108.95 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 C-N-CA 124.127 0.971 . . . . 0.0 109.306 172.24 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -71.72 135.39 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.142 1.377 . . . . 0.0 110.427 176.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.439 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 15.8 t70 -103.71 120.77 41.6 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 169.889 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -160.42 115.38 2.25 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 123.956 0.785 . . . . 0.0 110.004 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 m120 61.88 28.31 17.28 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.805 1.242 . . . . 0.0 111.838 -178.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.49 -7.69 56.78 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.564 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -93.13 137.89 32.06 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.903 0.881 . . . . 0.0 108.646 -177.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 16.2 pt-20 -108.72 129.92 55.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.137 0.575 . . . . 0.0 109.933 -178.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -127.07 125.54 41.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.975 0.51 . . . . 0.0 109.658 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.95 100.71 5.68 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -98.75 124.86 43.87 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -131.24 140.17 49.79 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.103 0.561 . . . . 0.0 110.261 -177.776 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -76.68 112.44 13.25 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 166.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 10.4 p -70.32 146.39 50.57 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -67.63 -9.46 43.29 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.435 1.094 . . . . 0.0 111.679 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.97 5.27 16.82 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.218 1.007 . . . . 0.0 111.448 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.53 40.46 15.36 Favored Glycine 0 C--N 1.353 1.492 0 C-N-CA 123.431 0.539 . . . . 0.0 112.702 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.0 mtpt -133.75 -171.4 2.71 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 122.816 0.446 . . . . 0.0 110.401 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 mt -114.88 163.91 14.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.943 0.897 . . . . 0.0 109.96 168.909 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.8 tp -152.18 103.05 2.83 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.0 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -90.96 102.15 14.92 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 178.915 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 74.4 p -118.04 153.72 33.23 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.339 0.655 . . . . 0.0 109.793 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptm . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 m -128.4 170.53 13.01 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.761 0.824 . . . . 0.0 110.165 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 68.89 5.67 5.14 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 125.417 1.487 . . . . 0.0 113.16 176.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.8 mtm -121.0 14.9 11.56 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.8 0.84 . . . . 0.0 112.018 -172.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -151.29 136.14 17.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.165 0.586 . . . . 0.0 110.209 178.285 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -106.33 168.17 9.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.988 0.915 . . . . 0.0 110.805 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.8 p -70.41 159.87 33.39 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.797 0.839 . . . . 0.0 112.272 179.203 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -61.57 142.68 56.94 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.429 1.091 . . . . 0.0 111.161 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.5 mt -107.52 92.05 7.96 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.093 0.957 . . . . 0.0 108.506 173.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -85.4 -164.38 0.23 Allowed 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.921 2.414 . . . . 0.0 112.002 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 63.3 94.33 0.05 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.922 1.289 . . . . 0.0 110.779 177.172 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -79.06 179.85 6.1 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.583 2.189 . . . . 0.0 111.898 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.75 172.16 9.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.363 0.665 . . . . 0.0 109.23 174.701 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -66.79 103.8 1.19 Allowed 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.226 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 56.8 mt -63.01 86.88 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.43 1.092 . . . . 0.0 111.368 -169.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.2 t70 58.25 -82.8 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.056 1.343 . . . . 0.0 111.399 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -158.97 27.18 0.21 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.297 1.046 . . . . 0.0 109.19 176.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -97.4 109.07 21.9 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.217 -176.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.2 t -74.34 172.74 11.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.162 0.585 . . . . 0.0 110.371 178.916 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.3 mt -88.94 -155.69 0.35 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.854 0.861 . . . . 0.0 110.744 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -58.58 147.6 69.38 Favored Pre-proline 0 N--CA 1.485 1.325 0 C-N-CA 123.724 0.81 . . . . 0.0 111.631 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.63 168.32 23.99 Favored 'Trans proline' 0 C--N 1.383 2.369 0 C-N-CA 122.972 2.448 . . . . 0.0 112.254 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.23 -58.33 3.35 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.865 0.466 . . . . 0.0 110.962 -176.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.11 148.03 9.82 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.69 0.796 . . . . 0.0 110.375 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' GLU . . . . . 0.458 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 48.7 mt-10 -113.8 35.53 4.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.716 0.806 . . . . 0.0 109.702 174.358 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HG3' HG13 ' A' ' 28' ' ' VAL . 14.3 tpt180 -82.82 85.39 7.1 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.539 178.058 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' ARG . . . . . 0.458 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 6.5 mpt_? -74.28 94.67 2.53 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.135 0.493 . . . . 0.0 109.855 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' VAL . . . . . 0.447 HG13 ' HG3' ' A' ' 26' ' ' ARG . 34.6 m -107.81 172.3 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.863 1.265 . . . . 0.0 108.377 171.459 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.429 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 5.0 m-20 -69.15 165.35 20.59 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.94 0.496 . . . . 0.0 111.497 176.522 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -59.24 -32.4 69.94 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.939 0.895 . . . . 0.0 110.991 168.959 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -55.94 -33.88 65.14 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.059 173.764 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.95 35.08 3.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.125 0.97 . . . . 0.0 111.046 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -46.78 -20.18 0.12 Allowed 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.475 HD22 ' HG3' ' A' ' 53' ' ' LYS . 95.2 mt -130.89 -56.65 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.299 0.64 . . . . 0.0 109.761 172.993 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.83 -158.05 53.07 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.037 -177.23 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -76.76 -10.31 18.4 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.873 2.382 . . . . 0.0 112.274 173.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -75.0 -51.87 12.53 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.787 0.835 . . . . 0.0 109.5 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.69 0.1 88.86 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.851 -176.199 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -154.14 98.05 2.11 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.9 m -143.29 166.62 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 122.945 0.498 . . . . 0.0 110.929 -173.625 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.7 mt -98.31 117.7 43.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.136 168.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -67.79 133.47 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 125.854 1.662 . . . . 0.0 110.112 174.746 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' ASP . . . . . 0.429 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 19.2 t70 -104.25 113.3 26.76 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -155.15 113.8 3.54 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.397 0.436 . . . . 0.0 111.092 -175.421 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.67 36.98 22.54 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.414 1.486 . . . . 0.0 110.646 172.615 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.64 -25.01 12.07 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.442 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -91.99 156.79 17.19 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.949 0.5 . . . . 0.0 110.03 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLU . . . . . 0.511 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -134.5 129.73 35.6 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.337 -174.836 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -134.19 133.29 40.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 122.4 -0.187 . . . . 0.0 110.508 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.61 110.98 12.88 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 59' ' ' LEU . 60.9 tp -108.07 127.12 53.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 170.173 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.94 144.73 51.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.093 0.473 . . . . 0.0 110.342 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.3 mtpt -83.75 98.53 9.74 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 169.839 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.6 p -63.78 139.64 58.79 Favored 'General case' 0 C--O 1.246 0.901 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -64.92 -12.66 51.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.431 1.082 . . . . 0.0 112.331 -176.092 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.64 -13.36 62.3 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.52 0.728 . . . . 0.0 111.569 171.207 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.02 37.74 4.56 Favored Glycine 0 C--N 1.349 1.288 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.153 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -132.36 165.25 24.65 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.669 0.388 . . . . 0.0 110.402 -175.157 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HB3' HD11 ' A' ' 51' ' ' LEU . 76.1 mt -100.97 142.3 32.64 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.725 0.81 . . . . 0.0 109.158 167.532 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.4 tp -130.97 104.18 6.97 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.079 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -93.29 101.59 13.84 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.5 p -115.91 152.44 33.44 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.563 1.145 . . . . 0.0 109.355 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.422 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.785 0.834 . . . . 0.0 108.802 -177.539 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.849 0.356 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.2 t -84.32 173.23 11.12 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.33 0.652 . . . . 0.0 109.258 171.652 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.593 ' HG3' ' SD ' ' A' ' 4' ' ' MET . 21.8 tpt180 -127.41 -89.24 0.54 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' MET . . . . . 0.593 ' SD ' ' HG3' ' A' ' 3' ' ' ARG . 1.9 mpt? -139.48 108.48 6.02 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.889 0.876 . . . . 0.0 108.657 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -165.48 167.22 17.75 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.573 0.749 . . . . 0.0 110.575 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -163.63 155.21 16.89 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.679 0.792 . . . . 0.0 110.0 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -64.14 104.88 0.79 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.989 0.916 . . . . 0.0 111.124 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -126.03 -170.33 2.17 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.496 1.119 . . . . 0.0 109.521 179.213 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.1 mt 67.23 102.33 0.04 OUTLIER Pre-proline 0 N--CA 1.487 1.388 0 C-N-CA 124.419 1.088 . . . . 0.0 109.949 -177.04 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -68.87 139.68 44.05 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.676 2.251 . . . . 0.0 112.165 -173.352 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 53.9 m80 -77.33 133.23 68.25 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.85 134.17 60.82 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.875 2.383 . . . . 0.0 112.41 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -111.49 16.44 20.74 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.115 0.966 . . . . 0.0 110.028 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 68.92 118.04 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.867 1.267 . . . . 0.0 110.385 -173.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.4 mt -84.57 68.31 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 68.3 148.13 0.06 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 125.585 1.554 . . . . 0.0 111.12 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.9 86.79 7.12 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -99.33 149.26 23.32 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.847 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 t -158.49 151.51 22.59 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.084 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.8 mt -87.95 159.84 18.16 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -117.21 95.0 46.43 Favored Pre-proline 0 C--O 1.242 0.681 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.183 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -65.38 -75.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.381 2.263 0 C-N-CA 122.484 2.123 . . . . 0.0 110.614 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 174.31 -56.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.979 1.312 . . . . 0.0 108.503 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.58 128.91 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.107 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -86.24 79.46 9.07 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.739 0.816 . . . . 0.0 109.94 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -142.42 96.15 2.9 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.93 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.7 mtm105 -85.32 96.95 9.69 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.212 0.53 . . . . 0.0 109.937 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -112.8 168.6 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.375 1.07 . . . . 0.0 108.899 171.662 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -57.26 159.51 4.52 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.512 0.725 . . . . 0.0 111.758 177.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.9 p -56.85 -27.39 60.26 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.901 0.88 . . . . 0.0 111.544 168.898 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.94 -37.3 76.4 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.863 0.865 . . . . 0.0 110.884 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -106.26 37.09 2.37 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.666 0.786 . . . . 0.0 110.869 174.672 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.524 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -49.55 -20.29 0.73 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LEU . . . . . 0.531 HD13 ' HD2' ' A' ' 53' ' ' LYS . 94.6 mt -126.22 -42.6 1.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.13 0.572 . . . . 0.0 110.299 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.66 -158.9 43.18 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.993 -176.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -79.07 -4.99 14.27 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.641 2.227 . . . . 0.0 112.189 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.89 -33.52 19.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.582 1.153 . . . . 0.0 110.876 -178.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.65 -4.32 60.83 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.81 -173.356 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.24 105.07 2.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.692 0.797 . . . . 0.0 110.357 -175.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.9 m -148.55 171.54 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.663 0.785 . . . . 0.0 110.05 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.0 mt -89.5 119.35 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 123.247 0.619 . . . . 0.0 109.799 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.69 137.62 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.498 1.519 . . . . 0.0 109.263 172.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -126.01 122.39 35.74 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 170.852 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 63.2 t60 -158.0 110.56 2.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.783 0.433 . . . . 0.0 111.101 -177.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 65.7 t30 59.37 30.94 20.71 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 125.015 1.326 . . . . 0.0 111.6 173.256 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -18.98 56.49 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.675 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -91.25 128.6 37.13 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.8 135.47 52.97 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.476 0.71 . . . . 0.0 109.97 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -139.01 164.43 29.78 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -103.63 126.62 50.89 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.237 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.3 tp -120.36 122.1 40.05 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 170.73 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -122.12 138.6 54.4 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.638 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -82.72 117.3 22.55 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 171.583 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.496 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 23.6 p -74.87 147.65 40.88 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -67.14 -12.99 61.51 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.6 -6.54 31.83 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.884 0.874 . . . . 0.0 111.859 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.23 37.94 7.47 Favored Glycine 0 C--N 1.355 1.613 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' LYS . . . . . 0.496 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 54.8 mtpt -136.54 -169.5 2.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.418 0.687 . . . . 0.0 110.405 -171.636 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LEU . . . . . 0.504 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.6 mt -118.33 166.38 12.7 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.753 1.221 . . . . 0.0 109.979 176.906 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.5 tp -153.43 103.75 2.69 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -93.99 101.76 13.82 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -177.664 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.6 p -118.03 133.31 56.03 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.208 1.003 . . . . 0.0 109.861 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.096 0 CA-C-O 120.59 0.233 . . . . 0.0 110.952 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.98 155.4 20.94 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 124.299 0.999 . . . . 0.0 109.243 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -108.49 23.32 14.7 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.525 ' HG3' HG13 ' A' ' 28' ' ' VAL . 17.6 tpp180 -88.55 95.98 10.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.375 0.67 . . . . 0.0 110.721 -176.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.57 90.22 4.52 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.863 0.465 . . . . 0.0 110.038 174.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.525 HG13 ' HG3' ' A' ' 26' ' ' ARG . 16.4 m -103.28 152.78 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.628 0.771 . . . . 0.0 109.438 170.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -62.02 157.13 19.49 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.583 0.753 . . . . 0.0 111.73 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 31.5 t -44.44 -40.59 5.62 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.962 1.705 . . . . 0.0 115.278 -174.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -64.22 -27.68 69.22 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 118.356 0.525 . . . . 0.0 111.44 -175.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.78 30.86 3.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.338 1.055 . . . . 0.0 111.007 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -48.3 -27.7 2.68 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.088 1.355 . . . . 0.0 114.439 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.6 mt -132.03 -53.27 0.98 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 -146.55 50.42 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.848 -172.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.31 -2.85 8.62 Favored 'Trans proline' 0 C--N 1.371 1.726 0 C-N-CA 122.582 2.188 . . . . 0.0 112.376 168.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -80.74 -60.1 2.43 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 123.822 0.849 . . . . 0.0 110.394 -176.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.28 -28.85 12.25 Favored Glycine 0 C--N 1.349 1.259 0 CA-C-O 119.662 -0.521 . . . . 0.0 114.37 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -134.43 95.42 3.38 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.109 0.954 . . . . 0.0 111.387 -177.304 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -143.11 161.36 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.396 0.678 . . . . 0.0 110.037 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 34.4 mt -89.72 124.83 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 C-N-CA 123.183 0.593 . . . . 0.0 109.62 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.513 HG23 ' HA ' ' A' ' 30' ' ' SER . 1.3 mp -81.86 119.45 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 C-N-CA 125.135 1.374 . . . . 0.0 109.438 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -96.24 109.44 21.92 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 175.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 49.6 t-80 -165.35 148.28 8.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.9 0.88 . . . . 0.0 109.872 -174.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.8 t30 69.04 23.48 6.54 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.396 1.079 . . . . 0.0 111.142 171.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.48 24.32 76.19 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.909 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -138.6 177.98 7.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.855 1.262 . . . . 0.0 109.494 -175.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -134.32 149.34 50.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.765 0.826 . . . . 0.0 108.866 169.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.677 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 3.6 p90 -158.84 125.59 4.71 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.493 0.717 . . . . 0.0 111.159 176.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -75.24 115.83 15.31 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.184 0.994 . . . . 0.0 109.843 -172.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 59' ' ' LEU . 55.7 tp -109.97 124.39 51.34 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 8.0 ptm180 -129.93 152.21 49.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.027 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -90.56 108.31 19.72 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 p -72.57 136.63 45.85 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -60.25 -27.23 67.06 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.177 0.991 . . . . 0.0 112.218 -174.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.46 -22.79 55.85 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.186 0.994 . . . . 0.0 112.039 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.51 41.31 0.96 Allowed Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.626 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -137.01 172.68 12.65 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.318 0.58 . . . . 0.0 111.79 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.8 mt -106.84 148.26 28.74 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.158 169.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.9 tp -137.92 99.59 3.94 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -89.69 122.47 32.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 177.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.6 p -135.16 131.66 37.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.615 0.766 . . . . 0.0 109.766 -174.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.677 ' HD2' ' HB3' ' A' ' 49' ' ' TYR . 30.3 mmmt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.261 1.024 . . . . 0.0 108.701 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.48 1.033 0 CA-C-O 120.87 0.367 . . . . 0.0 111.488 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.39 159.04 19.22 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.798 1.239 . . . . 0.0 108.95 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -114.12 22.49 13.79 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.311 0.577 . . . . 0.0 109.865 171.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -85.47 103.22 14.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.11 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -79.75 107.82 12.82 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.5 m -122.56 153.17 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -62.75 164.75 7.4 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.968 0.507 . . . . 0.0 111.932 -174.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.2 m -55.35 -33.76 63.66 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.934 0.894 . . . . 0.0 112.916 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.87 -32.47 69.51 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.155 0.982 . . . . 0.0 111.776 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -105.04 31.25 4.96 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.576 1.15 . . . . 0.0 111.443 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.461 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.5 pt? -45.51 -24.64 0.34 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -174.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.53 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 82.4 mt -123.05 -58.52 1.64 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.658 0.663 . . . . 0.0 111.227 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.71 -155.36 46.57 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 123.849 0.718 . . . . 0.0 112.906 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -73.64 -16.03 24.11 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 123.023 2.482 . . . . 0.0 112.001 172.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -79.63 -54.51 5.81 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.27 1.028 . . . . 0.0 110.73 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 82.47 3.48 90.51 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.482 -171.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.514 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -147.96 89.58 1.75 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.203 1.001 . . . . 0.0 110.009 -177.26 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 m -145.35 170.8 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.787 0.835 . . . . 0.0 110.537 -176.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 26.0 mt -94.33 112.31 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 123.409 0.683 . . . . 0.0 109.913 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -70.8 115.89 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.754 1.621 . . . . 0.0 110.476 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.44 104.05 16.22 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 171.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -102.63 86.53 2.79 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 168.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.0 m120 55.08 55.46 7.63 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.175 1.39 . . . . 0.0 111.329 176.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.9 -26.33 13.25 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.682 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.37 106.05 13.93 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 10.2 pt-20 -101.8 124.48 47.52 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.211 0.604 . . . . 0.0 111.443 -171.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.656 ' HB3' ' HB3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.32 135.34 38.82 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.914 0.886 . . . . 0.0 109.633 178.192 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -78.26 129.55 35.2 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 59' ' ' LEU . 61.0 tp -122.98 136.63 54.93 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -141.09 142.63 34.11 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.365 0.416 . . . . 0.0 111.796 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -78.69 102.83 8.25 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.348 0.659 . . . . 0.0 109.497 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -73.47 133.75 43.74 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -70.47 -8.25 49.63 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 124.011 0.82 . . . . 0.0 110.702 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.92 -18.29 59.77 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.562 1.145 . . . . 0.0 111.718 167.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.51 34.35 3.89 Favored Glycine 0 C--N 1.344 0.973 0 C-N-CA 123.414 0.53 . . . . 0.0 112.74 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -144.08 175.22 10.21 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.334 0.588 . . . . 0.0 111.47 -175.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.631 ' HB3' HD11 ' A' ' 51' ' ' LEU . 30.8 mt -106.86 146.97 30.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.751 1.221 . . . . 0.0 108.858 165.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -132.86 102.23 5.56 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.407 0.683 . . . . 0.0 109.203 -175.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -88.94 103.23 15.84 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 43.8 p -109.03 135.02 50.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.674 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HB3' ' HB3' ' A' ' 49' ' ' TYR . 22.6 pttm . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 123.65 0.78 . . . . 0.0 110.326 -176.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.835 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.54 149.55 9.87 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.161 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 35.0 mt-10 -100.45 28.53 4.97 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.962 0.905 . . . . 0.0 111.325 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -81.06 92.52 6.24 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.486 0.714 . . . . 0.0 111.099 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.472 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 11.1 mpt_? -74.48 106.77 6.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 174.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 m -140.5 145.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.782 1.233 . . . . 0.0 109.374 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' ASP . 59.8 t30 -60.95 159.95 10.58 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 -178.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.2 m -43.03 -30.43 0.43 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 174.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -55.49 -42.64 74.69 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.488 0.661 . . . . 0.0 111.175 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.94 37.54 1.94 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.557 1.143 . . . . 0.0 110.841 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.562 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -54.33 -22.46 12.18 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.536 HD13 ' HD2' ' A' ' 53' ' ' LYS . 96.0 mt -134.65 -52.53 0.81 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.253 0.549 . . . . 0.0 109.554 174.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.67 -152.26 50.33 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.024 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.35 3.8 6.7 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.83 2.353 . . . . 0.0 112.837 170.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.13 -58.16 2.56 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.595 0.758 . . . . 0.0 109.873 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.55 -22.91 29.55 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.364 -0.686 . . . . 0.0 113.779 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -133.67 101.27 5.05 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-N 118.493 1.147 . . . . 0.0 111.276 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.4 m -142.07 167.83 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 121.816 -0.552 . . . . 0.0 111.335 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.435 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 59.8 mt -92.68 111.62 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.47 1.108 . . . . 0.0 108.868 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -80.77 111.24 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.162 0.985 . . . . 0.0 109.663 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 29' ' ' ASN . 19.3 t70 -89.11 122.13 32.12 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.885 1.274 . . . . 0.0 107.935 174.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -171.48 143.55 1.8 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.276 0.63 . . . . 0.0 110.723 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.0 t30 62.92 21.34 12.81 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 124.696 1.198 . . . . 0.0 112.18 170.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.06 -4.49 78.01 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 121.872 -0.517 . . . . 0.0 113.527 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -120.26 171.7 8.31 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.718 0.771 . . . . 0.0 111.512 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.435 ' HB2' ' CG2' ' A' ' 41' ' ' ILE . 1.0 OUTLIER -129.82 137.73 50.62 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.294 179.556 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.509 ' HD1' ' HE3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -137.18 118.1 14.23 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.513 0.725 . . . . 0.0 109.087 -178.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -76.5 103.41 6.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.426 0.69 . . . . 0.0 109.235 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.462 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -104.68 118.74 37.33 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -123.85 134.51 53.57 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 123.764 0.665 . . . . 0.0 109.859 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.6 mtpm? -79.31 99.25 7.02 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 173.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -62.69 136.62 57.97 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 176.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -70.42 -4.83 24.42 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.636 0.774 . . . . 0.0 111.704 -177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.35 -11.84 60.17 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.57 1.148 . . . . 0.0 112.071 166.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.58 40.07 5.13 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 123.539 0.59 . . . . 0.0 112.289 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -140.89 170.84 14.99 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.87 0.468 . . . . 0.0 110.726 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD11 ' A' ' 51' ' ' LEU . 72.1 mt -106.78 139.73 40.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.479 1.112 . . . . 0.0 109.498 172.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -127.12 100.95 6.32 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.82 113.79 25.41 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.5 p -130.31 -179.12 5.07 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.972 1.309 . . . . 0.0 108.17 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HE3' ' HD1' ' A' ' 49' ' ' TYR . 46.1 mmtm . . . . . 0 C--O 1.251 1.168 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.959 0 CA-C-O 120.896 0.379 . . . . 0.0 110.377 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.63 149.23 26.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.841 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.43 24.13 13.17 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.721 0.808 . . . . 0.0 109.366 171.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -83.31 90.24 7.11 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.177 0.991 . . . . 0.0 110.123 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -77.58 96.49 4.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.2 m -119.99 156.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.431 1.092 . . . . 0.0 109.198 171.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -59.27 155.74 13.83 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.941 0.896 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -51.93 -26.81 11.15 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.584 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.6 -35.83 73.05 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.445 0.698 . . . . 0.0 111.701 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.71 40.63 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.946 0.898 . . . . 0.0 109.908 177.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -47.17 -16.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 177.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.526 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.1 mt -119.17 -32.18 4.48 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 121.728 -0.608 . . . . 0.0 110.636 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.25 -166.26 37.89 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.958 -177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.21 -10.32 19.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 122.631 2.22 . . . . 0.0 112.097 173.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -91.65 -24.12 19.63 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.785 0.834 . . . . 0.0 110.625 -175.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.46 -6.29 73.6 Favored Glycine 0 C--N 1.35 1.357 0 O-C-N 123.165 0.291 . . . . 0.0 112.592 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.63 110.2 3.8 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.136 0.974 . . . . 0.0 108.956 -177.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.2 m -146.75 171.89 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.448 0.699 . . . . 0.0 110.742 -176.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.6 mt -92.54 116.12 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.457 171.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.46 136.11 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 125.21 1.404 . . . . 0.0 109.505 174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -115.03 118.34 33.13 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 124.406 1.082 . . . . 0.0 108.404 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -152.45 113.81 4.27 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.458 0.473 . . . . 0.0 111.065 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 t30 63.54 28.9 15.34 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.821 1.248 . . . . 0.0 111.044 171.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.51 2.55 87.15 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.452 -0.794 . . . . 0.0 114.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -111.02 128.57 55.9 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.838 0.855 . . . . 0.0 109.086 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 15.4 pt-20 -113.02 137.82 50.82 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.284 0.634 . . . . 0.0 110.957 -175.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -135.31 149.53 49.78 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -100.35 109.51 21.69 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.854 0.752 . . . . 0.0 109.071 177.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 59' ' ' LEU . 51.0 tp -107.34 125.85 51.72 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.09 135.66 48.48 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 123.915 0.76 . . . . 0.0 110.54 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.526 ' HD2' HD13 ' A' ' 34' ' ' LEU . 62.0 mtpt -77.01 108.01 9.77 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -72.29 139.53 48.07 Favored 'General case' 0 C--O 1.249 1.039 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -74.07 -4.72 37.24 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.7 0.625 . . . . 0.0 111.015 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.8 -23.85 67.37 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 110.789 165.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.1 36.99 2.05 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.349 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -134.12 177.66 7.57 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.313 0.578 . . . . 0.0 111.413 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.493 ' HB3' HD11 ' A' ' 51' ' ' LEU . 89.6 mt -114.07 138.86 49.84 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.135 1.374 . . . . 0.0 108.35 169.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -133.28 102.27 5.49 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -174.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -86.06 121.8 29.18 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.9 p -130.49 158.62 39.44 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.996 0.918 . . . . 0.0 109.643 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 124.157 0.983 . . . . 0.0 109.01 -177.777 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 112.496 0.554 . . . . 0.0 112.496 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.58 -172.72 2.51 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 124.446 1.092 . . . . 0.0 110.398 175.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.25 27.17 8.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.323 1.049 . . . . 0.0 109.95 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -72.63 76.64 1.09 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.255 1.022 . . . . 0.0 109.524 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.42 ' HA ' ' HB ' ' A' ' 41' ' ' ILE . 2.7 ttm180 -82.91 86.23 6.99 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -171.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.5 m -113.67 154.0 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.227 1.011 . . . . 0.0 109.763 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.39 152.08 11.97 Favored 'General case' 0 CA--C 1.555 1.168 0 O-C-N 123.716 0.635 . . . . 0.0 111.042 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -50.04 -24.98 2.98 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -58.22 -33.4 69.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.729 0.412 . . . . 0.0 111.587 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.48 35.3 3.12 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.456 1.102 . . . . 0.0 110.401 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -53.62 -19.01 3.4 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.464 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.0 mt -133.11 -65.91 0.68 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 168.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.0 -155.29 53.15 Favored Glycine 0 CA--C 1.533 1.188 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.465 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -80.8 2.8 8.28 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 123.035 2.49 . . . . 0.0 112.828 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -97.79 -59.0 1.86 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.342 1.057 . . . . 0.0 109.465 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.27 -11.16 65.5 Favored Glycine 0 C--N 1.347 1.143 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HD2' ' O ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -141.54 78.74 1.65 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 122.866 1.317 . . . . 0.0 110.868 -175.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.98 159.94 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.773 -168.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 27' ' ' ARG . 50.7 mt -90.15 110.58 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.35 105.15 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.634 1.174 . . . . 0.0 109.997 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.3 121.7 24.77 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 166.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -145.83 100.3 3.39 Favored 'General case' 0 C--O 1.239 0.537 0 O-C-N 124.038 0.836 . . . . 0.0 109.101 -177.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 61.61 23.24 13.58 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.152 1.381 . . . . 0.0 111.641 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.79 -22.35 40.0 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.653 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -80.92 111.56 17.5 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.5 pt-20 -104.46 131.27 52.03 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.524 0.729 . . . . 0.0 110.222 -175.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HD2' HD21 ' A' ' 61' ' ' LEU . 5.6 p90 -148.52 123.86 10.27 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.124 0.57 . . . . 0.0 111.883 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.12 110.84 8.74 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.033 1.333 . . . . 0.0 110.061 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 59' ' ' LEU . 53.7 tp -104.37 129.41 52.29 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -131.93 133.86 45.01 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.546 0.529 . . . . 0.0 111.255 -174.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.464 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.5 mtpt -85.11 105.0 15.51 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.953 0.901 . . . . 0.0 109.491 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.1 p -71.92 145.27 48.59 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -63.3 -20.49 65.53 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 124.708 1.255 . . . . 0.0 112.323 -175.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . . . -64.77 -15.72 62.03 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.819 0.848 . . . . 0.0 111.767 172.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.93 37.94 4.78 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 124.27 0.938 . . . . 0.0 111.95 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 56' ' ' ALA . 43.9 mtmt -127.64 161.44 28.86 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 120.809 0.337 . . . . 0.0 111.417 -173.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.565 ' HB3' HD11 ' A' ' 51' ' ' LEU . 48.3 mt -110.34 126.81 54.63 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.187 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -115.93 114.69 25.0 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.747 1.219 . . . . 0.0 108.82 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.568 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.8 tm? -102.36 100.4 10.55 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.5 p -105.73 152.82 22.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.515 1.126 . . . . 0.0 108.922 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 123.13 0.572 . . . . 0.0 109.985 177.857 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.297 0 CA-C-O 120.965 0.412 . . . . 0.0 111.797 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -147.43 148.66 31.51 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 166.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -96.61 35.1 1.55 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.4 0.68 . . . . 0.0 109.882 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -95.0 92.23 6.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.823 0.849 . . . . 0.0 110.059 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -80.51 90.63 5.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 121.256 0.55 . . . . 0.0 109.798 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -117.64 157.58 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.158 0.983 . . . . 0.0 109.407 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -48.41 154.65 0.6 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 125.263 1.425 . . . . 0.0 112.813 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.6 m -54.59 -30.6 54.99 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.767 0.827 . . . . 0.0 111.568 170.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -53.52 -41.15 66.07 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.898 0.879 . . . . 0.0 111.683 172.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.65 36.72 2.33 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.837 0.855 . . . . 0.0 110.847 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -51.44 -21.54 2.43 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 114.671 1.359 . . . . 0.0 114.671 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.518 HD13 ' HD2' ' A' ' 53' ' ' LYS . 98.5 mt -123.25 -42.93 2.22 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.29 -157.66 52.59 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.892 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.64 3.69 7.52 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.852 2.368 . . . . 0.0 112.315 173.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -99.76 -54.06 3.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.304 1.042 . . . . 0.0 110.239 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 108.31 -11.34 36.63 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.824 -0.625 . . . . 0.0 114.459 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 pptp? -146.69 111.7 5.38 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 117.887 0.844 . . . . 0.0 110.772 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.8 m -147.06 167.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 124.219 1.008 . . . . 0.0 109.908 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.452 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 58.9 mt -90.75 120.85 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 172.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -79.77 110.17 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 124.897 1.279 . . . . 0.0 110.376 -177.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.93 137.43 34.21 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.673 167.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -160.27 95.69 1.15 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.248 1.019 . . . . 0.0 109.227 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.6 m120 65.06 31.18 11.28 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.3 1.04 . . . . 0.0 111.667 172.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.5 -15.16 62.51 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.999 -0.546 . . . . 0.0 113.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -87.61 142.92 27.47 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.8 pt-20 -129.31 137.13 50.84 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -152.41 124.8 8.21 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.487 0.715 . . . . 0.0 110.997 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -70.82 122.9 20.75 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.524 1.13 . . . . 0.0 109.912 -175.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.2 tp -113.27 127.2 56.08 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 168.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 ptm180 -128.48 135.62 49.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -75.95 99.36 4.51 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 166.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -65.17 138.73 58.45 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.39 -5.7 25.25 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 123.889 0.743 . . . . 0.0 111.57 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.22 -14.63 61.11 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.065 0.946 . . . . 0.0 111.492 165.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 33.29 6.57 Favored Glycine 0 C--N 1.352 1.452 0 C-N-CA 124.061 0.839 . . . . 0.0 112.024 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -137.9 -175.21 4.01 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.96 0.504 . . . . 0.0 110.703 -173.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.1 mt -112.26 159.07 18.98 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.716 1.206 . . . . 0.0 109.774 171.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.7 tp -147.11 105.92 3.84 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.469 HD21 ' HD2' ' A' ' 49' ' ' TYR . 2.4 tm? -99.6 101.21 12.35 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.0 p -120.11 132.68 55.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.055 0.942 . . . . 0.0 110.031 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' HB3' ' A' ' 49' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.284 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 171.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.478 0.948 0 CA-C-O 120.388 0.137 . . . . 0.0 110.944 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -170.67 141.87 1.92 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.804 0.69 . . . . 0.0 110.349 178.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -94.34 40.33 1.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.343 0.657 . . . . 0.0 110.38 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.463 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.0 tpm_? -91.15 90.69 7.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.067 0.947 . . . . 0.0 109.427 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.66 91.36 5.84 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.463 HG13 ' HG3' ' A' ' 26' ' ' ARG . 22.8 m -107.6 162.87 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.046 0.938 . . . . 0.0 109.172 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -66.13 164.03 16.4 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.859 0.463 . . . . 0.0 111.724 176.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 41.7 t -57.72 -28.7 64.11 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.388 1.075 . . . . 0.0 112.924 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -59.34 -32.65 70.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.052 0.541 . . . . 0.0 110.674 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.34 40.36 1.78 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.119 0.968 . . . . 0.0 110.117 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.512 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -46.54 -21.45 0.18 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.534 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -122.43 -33.0 3.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.923 0.489 . . . . 0.0 110.651 174.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.51 -152.56 52.36 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.296 -0.724 . . . . 0.0 112.445 -173.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.17 -13.69 12.44 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.667 2.245 . . . . 0.0 112.504 171.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -90.22 -43.0 10.7 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.882 0.873 . . . . 0.0 111.506 -170.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.474 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 94.58 -16.17 61.74 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.065 -171.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.537 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 6.5 ptpp? -130.36 93.28 3.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.736 0.814 . . . . 0.0 110.383 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.8 m -141.66 164.99 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.802 0.841 . . . . 0.0 110.515 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.0 mt -90.17 120.64 39.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.351 0.66 . . . . 0.0 109.243 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.512 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -78.76 132.01 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.032 1.333 . . . . 0.0 109.156 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.17 118.67 34.66 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 172.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . 0.492 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 6.1 t-80 -153.43 130.28 10.92 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.726 1.21 . . . . 0.0 110.735 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.63 5.89 88.25 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.414 -0.357 . . . . 0.0 113.064 -172.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -94.51 154.69 17.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.827 0.851 . . . . 0.0 109.753 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -123.36 131.59 53.7 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.25 0.62 . . . . 0.0 111.008 -171.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HB2' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -144.98 120.89 10.64 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.367 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -80.73 107.19 13.33 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.461 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.1 tp -103.09 123.62 47.0 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.452 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 7.9 ptm180 -128.92 133.47 47.88 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.293 -176.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -79.02 105.81 10.62 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 172.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -70.5 143.64 51.63 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.183 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -73.62 -3.34 27.41 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.867 0.867 . . . . 0.0 112.451 -174.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.83 -7.58 56.85 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.905 0.882 . . . . 0.0 110.912 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.29 37.19 5.69 Favored Glycine 0 C--N 1.35 1.32 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.595 177.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -129.5 166.69 19.14 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 120.987 0.422 . . . . 0.0 111.576 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.461 ' HB3' HD11 ' A' ' 51' ' ' LEU . 56.3 mt -104.7 127.24 52.4 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.137 0.975 . . . . 0.0 108.907 172.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.0 tp -121.0 103.17 8.83 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 49' ' ' TYR . 2.4 tm? -88.3 111.84 22.15 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.4 p -122.61 137.69 54.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.435 1.094 . . . . 0.0 108.959 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt . . . . . 0 CA--C 1.554 1.099 0 C-N-CA 123.652 0.781 . . . . 0.0 109.015 -175.961 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.465 0 CA-C-O 120.732 0.301 . . . . 0.0 111.58 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.01 142.39 10.29 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.675 1.19 . . . . 0.0 108.061 167.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.471 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 11.0 pt-20 -90.59 31.89 1.01 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.313 0.577 . . . . 0.0 111.115 178.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -84.14 94.63 8.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.536 1.134 . . . . 0.0 109.646 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.471 ' NH1' ' HB2' ' A' ' 25' ' ' GLU . 8.8 mpt_? -76.42 105.1 7.28 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.7 m -121.86 159.66 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.163 0.985 . . . . 0.0 108.906 170.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.51 155.17 33.73 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.066 0.546 . . . . 0.0 109.661 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -55.33 -20.99 13.2 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.85 1.26 . . . . 0.0 113.714 -175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -56.9 -38.79 73.31 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.382 0.673 . . . . 0.0 110.787 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.87 40.79 1.38 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.131 0.972 . . . . 0.0 110.511 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.21 -18.44 0.59 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 124.792 1.237 . . . . 0.0 114.232 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.24 -57.41 1.49 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.737 0.815 . . . . 0.0 109.488 167.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.27 -154.24 52.41 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.259 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -75.9 -17.56 17.54 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.435 2.09 . . . . 0.0 111.701 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.99 -41.75 73.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.28 1.032 . . . . 0.0 110.462 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.63 -5.81 49.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.795 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.62 105.3 2.42 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.575 1.15 . . . . 0.0 108.745 -178.214 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.8 m -144.22 169.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' TYR . 55.5 mt -90.07 110.87 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 114.353 -1.294 . . . . 0.0 108.63 169.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.516 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.8 132.28 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.208 1.403 . . . . 0.0 109.25 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -105.35 107.68 18.8 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 164.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -123.9 96.6 5.01 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -177.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 t30 60.61 42.44 13.95 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.59 1.156 . . . . 0.0 109.702 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.64 -18.7 28.48 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.82 -1.082 . . . . 0.0 114.072 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -83.96 118.55 24.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.802 0.841 . . . . 0.0 110.289 -176.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -88.56 133.12 34.26 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.799 0.439 . . . . 0.0 110.849 -179.669 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 41' ' ' ILE . 5.5 m-85 -131.14 177.45 7.45 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.78 108.39 9.83 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 59' ' ' LEU . 47.0 tp -104.41 124.19 48.78 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.446 ' HE ' HG22 ' A' ' 54' ' ' THR . 13.0 ptt180 -125.96 136.94 53.59 Favored 'General case' 0 C--O 1.242 0.67 0 O-C-N 123.482 0.488 . . . . 0.0 110.642 -177.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -79.15 99.12 6.83 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 168.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.446 HG22 ' HE ' ' A' ' 52' ' ' ARG . 35.8 p -68.62 149.06 49.59 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.748 178.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.33 -10.36 59.69 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 124.702 1.251 . . . . 0.0 113.218 -169.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.85 -14.34 59.91 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.472 0.709 . . . . 0.0 110.68 170.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.57 43.46 2.31 Favored Glycine 0 C--N 1.352 1.465 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.967 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -134.07 -179.49 5.59 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 116.806 0.303 . . . . 0.0 111.402 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 51' ' ' LEU . 83.5 mt -124.14 129.41 50.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.844 1.258 . . . . 0.0 109.818 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -123.56 105.1 9.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.674 0.79 . . . . 0.0 109.347 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' A' ' 51' ' ' LEU . 3.3 tm? -96.9 100.39 11.92 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.3 p -130.71 135.53 47.9 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.224 1.01 . . . . 0.0 109.617 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 123.94 0.896 . . . . 0.0 109.183 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.081 0 CA-C-O 121.028 0.442 . . . . 0.0 111.589 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.43 161.65 42.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.397 170.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -114.41 22.85 13.32 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.978 0.511 . . . . 0.0 109.987 171.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -77.18 88.61 3.64 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -77.14 87.85 3.61 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 121.803 0.811 . . . . 0.0 110.11 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -116.8 159.32 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 114.46 -1.246 . . . . 0.0 109.347 178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -59.37 161.43 5.65 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.913 0.885 . . . . 0.0 112.248 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.9 p -54.41 -30.33 51.92 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.068 0.947 . . . . 0.0 113.377 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -62.65 -30.79 71.63 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.643 0.377 . . . . 0.0 111.728 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.06 34.72 2.93 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.069 0.948 . . . . 0.0 110.661 176.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.421 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -49.48 -17.91 0.35 Allowed 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.529 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -125.58 -41.92 1.98 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.118 0.567 . . . . 0.0 110.089 174.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.67 -162.89 44.4 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.174 0.921 . . . . 0.0 112.699 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.5 -15.34 34.32 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.549 2.166 . . . . 0.0 112.274 172.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.92 -40.66 46.41 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.06 0.944 . . . . 0.0 111.165 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.51 -6.63 83.09 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.347 -169.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.03 122.05 7.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.497 1.119 . . . . 0.0 109.501 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.2 m -152.33 172.45 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.812 0.845 . . . . 0.0 110.248 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.3 mt -93.39 116.75 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 167.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 51' ' ' LEU . 1.4 mp -76.32 123.0 31.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 124.596 1.158 . . . . 0.0 109.302 177.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -97.75 122.01 40.33 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -157.94 117.18 3.22 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 123.314 0.646 . . . . 0.0 109.639 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.5 m120 66.88 16.97 10.49 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.78 1.232 . . . . 0.0 111.92 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.39 75.04 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 122.989 0.328 . . . . 0.0 113.069 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -90.46 156.98 17.81 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.751 0.82 . . . . 0.0 110.206 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.23 126.02 38.2 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.742 0.817 . . . . 0.0 109.717 -177.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.7 136.79 27.66 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.178 0.591 . . . . 0.0 109.655 177.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -84.63 123.98 30.95 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.039 0.935 . . . . 0.0 109.301 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.48 HD11 ' HB3' ' A' ' 59' ' ' LEU . 59.2 tp -119.5 136.8 54.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -139.76 143.83 37.13 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.499 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.529 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.4 mtpm? -83.02 98.99 9.56 Favored 'General case' 0 C--N 1.347 0.478 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -63.63 139.26 58.75 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -74.0 1.55 10.67 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -175.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.97 -18.79 63.37 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.548 0.739 . . . . 0.0 110.838 164.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.63 33.42 4.15 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.903 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.423 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.6 mtpt -134.94 -178.07 4.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.7 0.8 . . . . 0.0 111.253 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.48 ' HB3' HD11 ' A' ' 51' ' ' LEU . 69.8 mt -108.24 166.46 10.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.312 1.045 . . . . 0.0 109.99 169.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.4 tp -152.33 106.16 3.11 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.39 101.1 13.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -103.91 164.46 11.68 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.244 1.018 . . . . 0.0 108.991 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.255 1.347 0 CA-C-O 118.631 -0.699 . . . . 0.0 109.435 176.912 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.072 0 N-CA-C 112.093 0.405 . . . . 0.0 112.093 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -168.07 140.45 3.03 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.079 0.952 . . . . 0.0 109.448 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.36 24.91 4.71 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.619 0.723 . . . . 0.0 109.526 169.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -70.55 78.62 0.58 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.706 1.602 . . . . 0.0 110.143 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -81.36 91.07 6.21 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.755 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 m -122.76 154.13 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.64 1.176 . . . . 0.0 109.565 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -60.33 155.52 17.72 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.558 0.743 . . . . 0.0 111.111 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.443 ' HA ' HG23 ' A' ' 42' ' ' ILE . 48.3 p -51.44 -25.19 5.91 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -66.66 -25.71 66.7 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.422 0.63 . . . . 0.0 111.306 177.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.53 32.99 4.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.709 1.204 . . . . 0.0 110.469 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -50.03 -18.32 0.53 Allowed 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 124.593 1.157 . . . . 0.0 114.09 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.476 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.1 mt -126.4 -49.55 1.54 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.64 0.776 . . . . 0.0 109.715 170.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.08 -152.96 46.03 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-N 115.563 -0.744 . . . . 0.0 113.589 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.43 -17.0 21.47 Favored 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 122.682 2.255 . . . . 0.0 112.296 173.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -76.73 -38.78 53.66 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.192 0.997 . . . . 0.0 110.222 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.59 -0.24 70.97 Favored Glycine 0 C--N 1.347 1.178 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.953 -171.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.8 106.24 1.08 Allowed 'General case' 0 C--N 1.351 0.673 0 C-N-CA 124.427 1.091 . . . . 0.0 108.861 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.9 m -138.73 169.66 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.919 0.888 . . . . 0.0 110.034 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -91.76 109.02 20.72 Favored 'Isoleucine or valine' 0 C--O 1.243 0.756 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 164.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.443 HG23 ' HA ' ' A' ' 30' ' ' SER . 54.4 mt -61.12 132.41 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.033 0.933 . . . . 0.0 109.694 174.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -116.73 120.8 39.71 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 174.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -160.85 118.26 2.39 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.487 0.315 . . . . 0.0 111.269 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 t30 55.65 51.1 13.1 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.178 1.391 . . . . 0.0 111.68 171.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.43 -18.89 12.29 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.317 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -105.39 144.08 32.67 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.52 0.728 . . . . 0.0 110.232 -173.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.422 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.0 pt-20 -134.43 138.42 44.78 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.922 0.489 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -151.56 136.2 17.06 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.121 0.968 . . . . 0.0 110.236 -172.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.82 113.31 13.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.707 0.803 . . . . 0.0 109.957 -178.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.406 HD22 HD11 ' A' ' 42' ' ' ILE . 56.9 tp -104.29 138.8 40.21 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 169.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -141.29 146.66 37.06 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 111.058 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.4 mtpm? -78.64 107.64 11.46 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 167.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.7 p -67.33 130.07 41.89 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.44 -20.07 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 123.852 0.72 . . . . 0.0 111.148 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.44 -24.57 63.64 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.994 0.918 . . . . 0.0 111.187 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.03 43.03 0.88 Allowed Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.492 173.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -144.62 -174.39 4.31 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.102 0.561 . . . . 0.0 110.486 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.8 mt -116.07 142.93 46.15 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.669 1.188 . . . . 0.0 108.739 169.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -126.74 107.23 9.97 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -90.89 125.92 35.9 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 173.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -141.39 167.74 21.43 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.154 1.382 . . . . 0.0 108.491 -176.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? . . . . . 0 C--O 1.25 1.09 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 172.136 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.115 0 CA-C-O 121.08 0.467 . . . . 0.0 111.031 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.59 173.54 14.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.879 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.34 38.57 1.55 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 122.012 0.91 . . . . 0.0 109.454 172.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.0 ttt180 -82.33 95.75 7.71 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.939 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.78 95.01 3.94 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 m -131.36 158.2 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.03 0.932 . . . . 0.0 109.342 175.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -62.09 158.58 16.34 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.134 0.897 . . . . 0.0 110.913 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.5 t -54.12 -22.39 10.97 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.713 1.205 . . . . 0.0 113.813 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -58.39 -38.87 78.22 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.099 0.56 . . . . 0.0 110.915 175.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.03 36.37 2.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.981 0.913 . . . . 0.0 110.596 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.03 -24.12 6.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 124.553 1.141 . . . . 0.0 113.948 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -130.33 -69.52 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.107 0.563 . . . . 0.0 109.653 174.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.26 -161.6 50.15 Favored Glycine 0 CA--C 1.533 1.179 0 O-C-N 123.996 0.81 . . . . 0.0 112.071 -172.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.93 -11.83 31.39 Favored 'Trans proline' 0 C--N 1.37 1.706 0 C-N-CA 122.759 2.306 . . . . 0.0 112.448 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.39 -49.95 61.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.146 0.978 . . . . 0.0 109.662 174.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.47 3.58 78.15 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.877 -1.056 . . . . 0.0 113.36 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -161.62 110.46 1.52 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.239 1.016 . . . . 0.0 108.29 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 m -147.08 167.53 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 123.013 0.525 . . . . 0.0 110.334 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.1 mt -90.54 108.03 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 166.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.32 135.25 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.634 1.174 . . . . 0.0 109.41 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -115.69 127.06 54.88 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 124.521 1.128 . . . . 0.0 108.472 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -165.79 123.37 1.48 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.846 0.858 . . . . 0.0 109.688 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 67.3 26.77 8.46 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.588 1.155 . . . . 0.0 110.725 173.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.84 16.24 79.38 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.121 -176.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -114.96 133.67 55.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.061 0.944 . . . . 0.0 108.833 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -116.55 133.22 56.27 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.122 0.969 . . . . 0.0 110.541 -174.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -140.7 125.26 17.86 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -79.64 106.05 11.39 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.417 ' HB3' HD11 ' A' ' 42' ' ' ILE . 59.9 tp -101.99 131.36 48.45 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -138.4 140.34 39.31 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 123.836 0.71 . . . . 0.0 110.306 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -84.63 112.16 20.2 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 173.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 9.6 p -74.53 148.22 41.09 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.72 -8.61 44.34 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 124.17 0.919 . . . . 0.0 112.692 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.9 -3.83 37.54 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.591 0.757 . . . . 0.0 111.505 169.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.89 38.91 7.75 Favored Glycine 0 C--N 1.353 1.504 0 C-N-CA 123.355 0.503 . . . . 0.0 112.12 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 22.8 mtpp -130.97 -178.48 4.84 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.155 0.582 . . . . 0.0 110.675 -174.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.7 mt -111.3 156.24 21.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.46 1.104 . . . . 0.0 109.39 169.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.3 tp -144.76 101.57 3.67 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 176.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -84.56 114.73 22.18 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 174.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.7 p -126.45 154.79 43.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.502 1.121 . . . . 0.0 108.565 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.921 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.473 0.724 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.01 117.54 1.21 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 123.848 0.717 . . . . 0.0 109.637 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.58 69.58 7.11 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.807 0.843 . . . . 0.0 109.196 173.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -125.67 88.73 2.91 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.594 0.758 . . . . 0.0 109.114 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.1 mtp85 -81.33 90.39 6.14 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.523 0.678 . . . . 0.0 110.375 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.5 m -121.34 157.73 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.758 1.223 . . . . 0.0 109.173 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -64.62 156.93 28.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.569 0.747 . . . . 0.0 110.148 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.8 t -56.41 -20.16 18.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.362 1.065 . . . . 0.0 113.787 -174.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -54.88 -40.85 70.18 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.771 0.828 . . . . 0.0 111.372 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.78 40.31 1.4 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.491 1.116 . . . . 0.0 110.347 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -48.08 -18.53 0.2 Allowed 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.57 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 86.0 mt -117.25 -33.49 4.64 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.538 0.608 . . . . 0.0 110.963 176.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.66 -145.61 45.68 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-O 118.939 -0.923 . . . . 0.0 112.465 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -88.1 -13.41 3.75 Favored 'Trans proline' 0 C--N 1.369 1.64 0 C-N-CA 122.98 2.453 . . . . 0.0 112.92 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -91.72 -29.15 16.98 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.591 0.757 . . . . 0.0 111.538 -173.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.57 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 86.11 0.67 86.99 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -165.101 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -146.46 119.74 8.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.729 1.212 . . . . 0.0 109.197 -176.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.437 HG23 HD12 ' A' ' 42' ' ' ILE . 35.7 m -151.1 171.6 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.137 0.975 . . . . 0.0 109.601 178.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 62.1 mt -91.35 106.54 17.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 168.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.437 HD12 HG23 ' A' ' 40' ' ' VAL . 1.6 mp -68.48 137.08 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 124.726 1.21 . . . . 0.0 109.926 176.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -112.4 126.57 55.43 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 169.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -164.47 140.68 6.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 173.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 66.55 14.76 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.097 1.359 . . . . 0.0 111.442 -175.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.29 -5.38 72.84 Favored Glycine 0 C--N 1.352 1.459 0 C-N-CA 123.329 0.49 . . . . 0.0 112.8 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -95.76 161.46 14.01 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.408 1.083 . . . . 0.0 109.782 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.45 138.52 54.01 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.333 0.653 . . . . 0.0 110.14 -178.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 140.21 26.16 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.04 122.72 30.46 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -114.07 135.1 54.39 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 167.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -138.86 137.8 36.88 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.505 0.503 . . . . 0.0 111.094 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.562 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -79.01 102.38 8.31 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 169.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.3 p -65.74 140.28 58.43 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -75.44 -0.59 20.57 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.126 0.489 . . . . 0.0 111.676 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.93 -1.51 22.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.895 0.878 . . . . 0.0 111.236 163.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.32 35.57 8.68 Favored Glycine 0 C--N 1.35 1.356 0 C-N-CA 124.018 0.818 . . . . 0.0 112.571 174.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -133.96 173.85 11.12 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.667 0.387 . . . . 0.0 111.362 -174.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.473 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.6 mt -110.15 136.18 49.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.939 1.295 . . . . 0.0 109.274 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.33 98.7 5.55 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -92.8 104.67 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -115.28 126.78 54.91 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.613 1.165 . . . . 0.0 108.88 175.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.909 -175.972 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.596 ' HB3' HD11 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.478 0.958 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.09 163.97 28.34 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.208 0.603 . . . . 0.0 110.735 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.02 24.58 8.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 110.13 172.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -81.28 93.71 6.59 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.919 0.487 . . . . 0.0 110.874 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 102.46 4.43 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.3 m -123.32 157.61 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.705 1.202 . . . . 0.0 108.136 168.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 7.1 p30 -74.03 167.05 22.3 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 122.941 0.151 . . . . 0.0 110.675 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -48.56 -30.94 5.81 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -172.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -62.81 -31.86 72.93 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 118.503 0.592 . . . . 0.0 111.197 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.86 30.07 5.39 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.391 1.077 . . . . 0.0 110.202 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.6 pt? -48.94 -29.33 4.64 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.523 1.129 . . . . 0.0 113.833 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 93.3 mt -130.97 -69.92 0.62 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 109.735 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.9 -151.66 52.12 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.932 -174.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.27 -13.66 25.59 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 122.523 2.148 . . . . 0.0 112.437 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.7 -60.49 2.21 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.167 0.987 . . . . 0.0 110.397 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.72 -17.33 45.73 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-N 114.822 -1.081 . . . . 0.0 113.178 -175.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -136.45 99.38 4.07 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.654 0.782 . . . . 0.0 110.108 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.69 165.3 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 124.02 0.928 . . . . 0.0 109.468 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.416 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 54.6 mt -90.19 118.54 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.257 0.623 . . . . 0.0 109.666 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 mp -78.56 131.09 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.972 1.309 . . . . 0.0 110.009 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.5 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 12.2 t70 -104.13 122.29 45.01 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 124.894 1.277 . . . . 0.0 107.781 171.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -156.98 110.53 2.61 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.31 0.644 . . . . 0.0 109.366 -175.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 61.65 28.25 17.46 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.155 0.982 . . . . 0.0 111.375 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.54 -9.35 76.15 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.862 -0.608 . . . . 0.0 113.464 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -81.18 138.38 35.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.445 0.698 . . . . 0.0 109.972 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.45 124.75 52.91 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.879 0.871 . . . . 0.0 108.69 177.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.479 ' HD2' HD21 ' A' ' 61' ' ' LEU . 8.7 p90 -152.6 125.07 8.23 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.81 0.444 . . . . 0.0 112.054 177.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.596 HD11 ' HB3' ' A' ' 23' ' ' ALA . 3.2 tm? -77.93 115.54 17.74 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.611 1.165 . . . . 0.0 109.455 -173.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.441 HD11 ' HB3' ' A' ' 59' ' ' LEU . 36.0 tp -104.56 131.17 52.28 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 171.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' ' 60' ' ' LEU . 15.7 ptm180 -134.52 134.31 41.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.043 0.839 . . . . 0.0 110.688 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.458 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.8 mtpm? -82.74 103.9 12.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.2 p -64.93 144.01 57.57 Favored 'General case' 0 C--O 1.253 1.254 0 O-C-N 123.968 0.793 . . . . 0.0 109.362 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -68.87 -11.63 60.73 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.358 1.063 . . . . 0.0 112.146 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.93 -0.87 17.47 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.933 0.893 . . . . 0.0 111.431 169.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.96 44.53 7.62 Favored Glycine 0 C--N 1.354 1.53 0 C-N-CA 123.585 0.612 . . . . 0.0 112.2 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -139.39 174.97 9.97 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 122.555 0.342 . . . . 0.0 110.748 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.441 ' HB3' HD11 ' A' ' 51' ' ' LEU . 80.9 mt -109.14 135.27 50.55 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.351 1.061 . . . . 0.0 109.957 171.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' HD3' ' A' ' 52' ' ' ARG . 14.6 tp -125.0 106.34 9.88 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . 0.479 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.4 tm? -89.13 100.95 13.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 67.3 p -108.91 159.76 16.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 C--O 1.252 1.191 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.981 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.47 0.53 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -153.2 143.25 22.24 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.208 -1.36 . . . . 0.0 109.262 172.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -86.3 30.96 0.67 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.467 0.707 . . . . 0.0 111.571 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.461 ' HG3' HG13 ' A' ' 28' ' ' VAL . 7.8 tpp180 -87.96 92.87 9.29 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.097 0.559 . . . . 0.0 109.616 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -79.72 103.76 9.84 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.461 HG13 ' HG3' ' A' ' 26' ' ' ARG . 20.8 m -110.88 154.1 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -52.44 150.13 5.13 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.481 0.712 . . . . 0.0 111.02 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . 0.539 ' HA ' HG23 ' A' ' 42' ' ' ILE . 15.5 m -47.24 -35.17 7.32 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -58.09 -32.32 67.96 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.902 0.881 . . . . 0.0 112.202 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.66 31.23 4.86 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.284 1.034 . . . . 0.0 111.75 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -46.2 -22.83 0.27 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -178.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -125.31 -68.9 0.81 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.472 0.709 . . . . 0.0 109.923 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.78 -153.59 51.54 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 113.457 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -70.5 -16.65 34.46 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.983 2.456 . . . . 0.0 112.247 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.56 -56.64 3.75 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.834 0.854 . . . . 0.0 110.167 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.9 -10.01 64.12 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-N 114.799 -1.091 . . . . 0.0 113.397 -175.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -136.41 73.53 1.46 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.198 0.999 . . . . 0.0 110.708 -175.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 19.6 m -135.88 161.15 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.008 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 35.1 mt -86.83 121.79 38.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.08 -178.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 51' ' ' LEU . 48.8 mt -69.6 105.9 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.798 0.839 . . . . 0.0 109.39 173.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -87.16 121.52 29.73 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 172.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -147.46 95.71 2.58 Favored 'General case' 0 C--O 1.241 0.658 0 O-C-N 123.869 0.731 . . . . 0.0 110.035 -175.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 23.6 m120 58.42 45.15 17.13 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.422 1.089 . . . . 0.0 112.034 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.84 -26.41 6.02 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 113.709 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.71 107.7 15.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -101.42 138.56 38.27 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.641 0.776 . . . . 0.0 109.675 178.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.605 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -147.69 126.43 12.61 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.544 0.737 . . . . 0.0 109.035 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 2.9 tm? -71.71 126.14 28.94 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.115 0.566 . . . . 0.0 110.382 -174.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.0 tp -117.15 119.74 36.15 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 172.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.9 ptm180 -126.6 136.27 52.31 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.944 0.402 . . . . 0.0 110.616 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -76.36 99.6 4.88 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.5 p -64.39 138.2 58.29 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -72.38 -7.11 47.95 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 124.764 1.29 . . . . 0.0 111.341 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.76 -18.76 62.76 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.888 0.875 . . . . 0.0 111.088 168.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.89 38.33 2.2 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.984 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -140.78 176.75 8.54 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.305 0.574 . . . . 0.0 111.428 -174.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.1 mt -108.15 136.58 47.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 109.133 169.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -119.34 103.69 9.71 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -91.42 124.75 35.84 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.6 p -136.72 120.54 17.43 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.1 0.96 . . . . 0.0 108.981 -174.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HD3' ' HB3' ' A' ' 49' ' ' TYR . 35.1 mmtp . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.021 0.928 . . . . 0.0 109.819 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.481 1.096 0 N-CA-C 112.672 0.619 . . . . 0.0 112.672 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -166.01 114.67 0.95 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.12 0.568 . . . . 0.0 110.76 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.17 100.23 4.22 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-O 121.992 0.901 . . . . 0.0 109.442 175.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -150.61 91.22 1.71 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 108.865 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.74 86.78 3.36 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.447 -176.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.8 m -101.33 167.58 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.451 1.1 . . . . 0.0 108.048 172.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -55.01 149.22 12.19 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.589 0.756 . . . . 0.0 111.343 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 t -58.71 -26.12 63.59 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.33 0.652 . . . . 0.0 111.609 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -60.49 -35.72 76.61 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.757 0.823 . . . . 0.0 110.983 172.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.54 30.54 3.54 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.193 0.997 . . . . 0.0 110.972 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -47.03 -28.44 1.68 Allowed 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.918 1.287 . . . . 0.0 114.324 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 88.7 mt -121.37 -56.12 1.91 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.499 0.72 . . . . 0.0 109.376 175.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.25 -151.75 50.23 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.333 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.86 -13.13 14.51 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.535 2.157 . . . . 0.0 112.496 172.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.58 -43.44 15.67 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.672 0.789 . . . . 0.0 110.488 -177.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 79.0 4.32 88.66 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.449 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 17.3 ptpt -151.59 75.23 1.16 Allowed 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.756 0.789 . . . . 0.0 110.387 -173.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -141.46 169.6 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.124 -175.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 48' ' ' GLU . 23.0 mt -91.59 125.08 44.32 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 CA-C-O 121.499 0.666 . . . . 0.0 110.9 -178.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -62.96 134.8 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.839 1.656 . . . . 0.0 109.464 168.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -114.72 115.52 27.21 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 163.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -126.73 87.23 2.62 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.1 t30 66.66 22.43 10.44 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 124.617 1.167 . . . . 0.0 110.766 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.57 -4.99 56.79 Favored Glycine 0 C--N 1.351 1.416 0 O-C-N 121.772 -0.58 . . . . 0.0 113.333 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -81.55 108.08 14.83 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.597 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 9.8 pt-20 -98.25 135.21 40.21 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.477 0.486 . . . . 0.0 111.303 -174.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -145.71 125.9 13.82 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 123.555 0.742 . . . . 0.0 110.021 175.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -78.91 103.18 8.68 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.565 0.62 . . . . 0.0 109.55 176.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.0 tp -96.72 132.33 42.51 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 17.1 ptm180 -138.7 137.75 37.09 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 123.54 0.525 . . . . 0.0 111.214 -175.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -81.47 99.23 8.64 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.431 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 17.1 p -67.7 142.47 56.31 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 123.899 0.749 . . . . 0.0 109.412 -177.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -64.01 -16.35 61.43 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 124.877 1.361 . . . . 0.0 112.004 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.08 -7.63 31.06 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.174 0.99 . . . . 0.0 112.459 171.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.02 42.66 5.9 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.687 0.661 . . . . 0.0 112.007 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.8 mtpt -140.98 177.84 7.78 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.092 0.557 . . . . 0.0 110.479 -172.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.2 mt -114.24 143.61 44.57 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.646 1.178 . . . . 0.0 109.198 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.537 ' HG ' HG23 ' A' ' 62' ' ' THR . 17.9 tp -132.98 105.32 7.01 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -89.61 102.11 14.79 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . 0.537 HG23 ' HG ' ' A' ' 60' ' ' LEU . 25.6 p -129.14 123.13 31.34 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.9 0.88 . . . . 0.0 109.913 -175.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 48' ' ' GLU . 24.1 tptp . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . . . . . . 0 N--CA 1.486 1.371 0 N-CA-C 106.813 -1.551 . . . . 0.0 106.813 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.44 118.15 1.91 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.72 1.208 . . . . 0.0 108.518 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -71.05 90.39 0.84 Allowed 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.149 0.58 . . . . 0.0 109.587 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -139.01 84.2 2.0 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.09 0.956 . . . . 0.0 108.883 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -75.94 86.18 2.87 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.341 0.591 . . . . 0.0 110.24 -177.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -109.93 149.11 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 124.468 1.107 . . . . 0.0 108.216 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -51.83 157.87 1.12 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.591 1.156 . . . . 0.0 112.702 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -54.05 -28.05 36.27 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.209 1.004 . . . . 0.0 113.301 179.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -62.12 -34.98 77.36 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.999 0.428 . . . . 0.0 110.654 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.4 35.59 2.08 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.589 1.156 . . . . 0.0 110.695 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -47.71 -21.53 0.39 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.9 mt -130.49 -43.3 1.14 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.256 0.623 . . . . 0.0 109.917 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.63 -158.6 51.21 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.62 -175.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.95 -14.47 15.33 Favored 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 169.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -79.2 -35.42 41.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.878 0.871 . . . . 0.0 111.077 -174.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.0 -11.13 63.35 Favored Glycine 0 C--N 1.352 1.453 0 N-CA-C 114.665 0.626 . . . . 0.0 114.665 171.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -149.58 85.9 1.45 Allowed 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.054 0.927 . . . . 0.0 110.183 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -131.58 171.32 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.393 0.677 . . . . 0.0 110.462 -171.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.421 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 32.9 mt -99.91 123.22 52.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 123.183 0.593 . . . . 0.0 109.805 176.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -73.55 122.7 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 124.896 1.279 . . . . 0.0 109.011 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -93.59 123.03 36.64 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -148.63 96.71 2.63 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.706 0.802 . . . . 0.0 109.959 -177.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.4 HD22 ' N ' ' A' ' 45' ' ' ASN . 0.8 OUTLIER 59.15 30.94 20.83 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.576 1.151 . . . . 0.0 112.15 172.074 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.11 -22.3 39.89 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-O 119.698 -0.501 . . . . 0.0 113.397 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -83.6 153.53 24.26 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.8 pt-20 -133.92 135.3 43.5 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.166 0.291 . . . . 0.0 110.617 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -135.52 113.9 11.56 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -70.21 110.59 5.29 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 175.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.403 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.4 tp -106.56 118.62 37.13 Favored 'General case' 0 C--O 1.249 1.041 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.6 ptm180 -123.6 137.05 54.82 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.979 0.512 . . . . 0.0 110.76 -177.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -78.47 99.32 6.39 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -69.58 142.84 53.48 Favored 'General case' 0 C--O 1.251 1.174 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -69.44 -10.3 57.39 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.105 0.962 . . . . 0.0 111.602 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.61 -24.41 67.56 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.572 0.749 . . . . 0.0 110.948 167.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.94 37.53 2.71 Favored Glycine 0 C--N 1.35 1.307 0 C-N-CA 124.358 0.98 . . . . 0.0 111.733 -179.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.9 mtpt -135.02 176.04 9.03 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.444 0.64 . . . . 0.0 111.524 -172.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.403 ' HB3' HD11 ' A' ' 51' ' ' LEU . 49.8 mt -109.58 141.71 41.69 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.035 -1.438 . . . . 0.0 107.405 163.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 tp -131.5 103.08 6.21 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -88.54 113.19 23.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 p -137.63 142.03 41.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.534 1.134 . . . . 0.0 108.884 -175.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 122.972 0.509 . . . . 0.0 109.653 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.645 0 N-CA-C 112.999 0.74 . . . . 0.0 112.999 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.99 161.1 41.48 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.402 1.081 . . . . 0.0 108.933 171.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -111.07 29.59 7.65 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.894 0.854 . . . . 0.0 109.238 168.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -82.25 86.23 6.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.778 0.831 . . . . 0.0 109.947 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -77.15 87.5 3.61 Favored 'General case' 0 C--N 1.36 1.023 0 CA-C-O 121.091 0.472 . . . . 0.0 110.185 177.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.5 m -101.86 154.35 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 173.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -58.6 150.55 22.78 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.097 0.559 . . . . 0.0 109.764 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 p -51.04 -25.05 4.33 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -175.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -56.29 -38.73 71.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.82 0.848 . . . . 0.0 111.506 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.37 36.29 2.19 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.969 0.908 . . . . 0.0 110.777 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -46.39 -26.26 0.8 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.558 1.543 . . . . 0.0 115.029 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 97.5 mt -127.38 -54.34 1.36 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 122.824 0.45 . . . . 0.0 110.089 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 -158.46 53.39 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.488 -175.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -78.21 -7.55 16.16 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.372 2.048 . . . . 0.0 112.031 172.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.92 -48.35 13.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.459 1.104 . . . . 0.0 110.467 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.22 -12.9 61.16 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.898 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -142.9 89.46 2.12 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 117.579 0.69 . . . . 0.0 110.761 -177.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.3 m -140.56 163.01 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 123.213 0.605 . . . . 0.0 110.363 -175.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 25.7 mt -88.49 125.41 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -81.15 119.57 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.246 1.419 . . . . 0.0 109.329 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -103.19 115.4 30.5 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -161.99 142.07 10.15 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.158 0.983 . . . . 0.0 108.729 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . 0.472 ' HB2' HE21 ' A' ' 47' ' ' GLN . 17.6 m-80 70.18 12.61 7.69 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.554 1.542 . . . . 0.0 111.611 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.0 83.09 Favored Glycine 0 C--N 1.345 1.034 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 -170.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . 0.472 HE21 ' HB2' ' A' ' 45' ' ' ASN . 40.6 mt-30 -111.15 158.05 19.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.348 1.059 . . . . 0.0 108.683 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.74 125.86 27.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 122.811 0.444 . . . . 0.0 110.435 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -148.5 126.78 12.21 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 111.273 -174.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.527 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 3.3 tm? -75.29 122.74 24.17 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.855 1.262 . . . . 0.0 110.722 -172.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' A' ' 59' ' ' LEU . 54.9 tp -111.29 127.04 55.5 Favored 'General case' 0 C--O 1.245 0.866 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 167.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.448 ' HD3' HD23 ' A' ' 60' ' ' LEU . 16.9 ptm180 -128.24 142.93 51.02 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.71 0.631 . . . . 0.0 110.564 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.42 ' HD2' HD13 ' A' ' 34' ' ' LEU . 27.5 mtpp -83.59 104.88 14.07 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.717 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.2 p -71.4 134.23 46.5 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 172.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -72.98 -0.64 14.33 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.964 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.15 -14.21 61.76 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.953 0.901 . . . . 0.0 110.715 166.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.82 35.15 4.11 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.501 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -139.42 173.52 11.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.006 0.523 . . . . 0.0 111.289 -174.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 51' ' ' LEU . 59.7 mt -111.26 144.42 40.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.301 1.04 . . . . 0.0 109.242 174.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . 0.448 HD23 ' HD3' ' A' ' 52' ' ' ARG . 16.3 tp -132.47 113.83 13.58 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -177.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.76 124.52 35.95 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 80.9 p -142.39 -169.59 3.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.155 1.782 . . . . 0.0 106.534 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HA ' ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 121.548 -0.72 . . . . 0.0 110.577 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB1' ' HD3' ' A' ' 39' ' ' LYS . . . . . . . . 0 N--CA 1.481 1.106 0 N-CA-C 111.587 0.217 . . . . 0.0 111.587 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 39' ' ' LYS . . . -164.58 118.8 1.37 Allowed 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.748 0.819 . . . . 0.0 109.606 172.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -77.83 85.52 4.1 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 122.036 0.922 . . . . 0.0 109.789 177.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.401 ' HG3' HG13 ' A' ' 28' ' ' VAL . 19.7 tpp180 -137.47 90.08 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.719 -178.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -74.85 89.66 2.35 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.529 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.401 HG13 ' HG3' ' A' ' 26' ' ' ARG . 23.5 m -112.61 161.11 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.006 1.323 . . . . 0.0 109.214 172.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.439 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 58.5 t30 -69.66 160.62 31.25 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.401 0.68 . . . . 0.0 109.972 175.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.5 m -50.04 -27.56 5.74 Favored 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 124.45 1.1 . . . . 0.0 113.89 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -57.27 -34.59 68.81 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.59 0.756 . . . . 0.0 111.694 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.59 40.83 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.106 0.962 . . . . 0.0 110.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -50.56 -20.25 1.12 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -132.21 -54.2 0.97 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.301 0.64 . . . . 0.0 109.317 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.79 -144.46 45.28 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.974 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -79.85 -12.48 13.43 Favored 'Trans proline' 0 C--N 1.376 2.016 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.95 -42.9 13.65 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.572 -174.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.69 3.07 86.8 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.697 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HD3' ' HB1' ' A' ' 23' ' ' ALA . 8.4 ptpp? -160.58 109.82 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.2 m -148.57 174.92 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 123.701 0.8 . . . . 0.0 111.011 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . 0.404 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 58.8 mt -98.63 108.95 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 C-N-CA 124.127 0.971 . . . . 0.0 109.306 172.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -71.72 135.39 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.142 1.377 . . . . 0.0 110.427 176.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.439 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 15.8 t70 -103.71 120.77 41.6 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 169.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -160.42 115.38 2.25 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 123.956 0.785 . . . . 0.0 110.004 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 m120 61.88 28.31 17.28 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.805 1.242 . . . . 0.0 111.838 -178.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.49 -7.69 56.78 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.564 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -93.13 137.89 32.06 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.903 0.881 . . . . 0.0 108.646 -177.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 16.2 pt-20 -108.72 129.92 55.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.137 0.575 . . . . 0.0 109.933 -178.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -127.07 125.54 41.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.975 0.51 . . . . 0.0 109.658 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.95 100.71 5.68 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -98.75 124.86 43.87 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -131.24 140.17 49.79 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.103 0.561 . . . . 0.0 110.261 -177.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -76.68 112.44 13.25 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 166.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 10.4 p -70.32 146.39 50.57 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -67.63 -9.46 43.29 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.435 1.094 . . . . 0.0 111.679 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.97 5.27 16.82 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.218 1.007 . . . . 0.0 111.448 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.53 40.46 15.36 Favored Glycine 0 C--N 1.353 1.492 0 C-N-CA 123.431 0.539 . . . . 0.0 112.702 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.0 mtpt -133.75 -171.4 2.71 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 122.816 0.446 . . . . 0.0 110.401 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 mt -114.88 163.91 14.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.943 0.897 . . . . 0.0 109.96 168.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.8 tp -152.18 103.05 2.83 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -90.96 102.15 14.92 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 178.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 74.4 p -118.04 153.72 33.23 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.339 0.655 . . . . 0.0 109.793 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.471 0.597 0 CA-C-O 120.336 0.112 . . . . 0.0 110.962 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.11 148.03 9.82 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.69 0.796 . . . . 0.0 110.375 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . 0.458 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 48.7 mt-10 -113.8 35.53 4.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.716 0.806 . . . . 0.0 109.702 174.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HG3' HG13 ' A' ' 28' ' ' VAL . 14.3 tpt180 -82.82 85.39 7.1 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.539 178.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . 0.458 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 6.5 mpt_? -74.28 94.67 2.53 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.135 0.493 . . . . 0.0 109.855 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . 0.447 HG13 ' HG3' ' A' ' 26' ' ' ARG . 34.6 m -107.81 172.3 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.863 1.265 . . . . 0.0 108.377 171.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.429 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 5.0 m-20 -69.15 165.35 20.59 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.94 0.496 . . . . 0.0 111.497 176.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -59.24 -32.4 69.94 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.939 0.895 . . . . 0.0 110.991 168.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -55.94 -33.88 65.14 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.059 173.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.95 35.08 3.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.125 0.97 . . . . 0.0 111.046 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -46.78 -20.18 0.12 Allowed 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.475 HD22 ' HG3' ' A' ' 53' ' ' LYS . 95.2 mt -130.89 -56.65 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.299 0.64 . . . . 0.0 109.761 172.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.83 -158.05 53.07 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.037 -177.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -76.76 -10.31 18.4 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.873 2.382 . . . . 0.0 112.274 173.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -75.0 -51.87 12.53 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.787 0.835 . . . . 0.0 109.5 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.69 0.1 88.86 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.851 -176.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -154.14 98.05 2.11 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.9 m -143.29 166.62 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 122.945 0.498 . . . . 0.0 110.929 -173.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.7 mt -98.31 117.7 43.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.136 168.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -67.79 133.47 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 125.854 1.662 . . . . 0.0 110.112 174.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . 0.429 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 19.2 t70 -104.25 113.3 26.76 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -155.15 113.8 3.54 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.397 0.436 . . . . 0.0 111.092 -175.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.67 36.98 22.54 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.414 1.486 . . . . 0.0 110.646 172.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.64 -25.01 12.07 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.442 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -91.99 156.79 17.19 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.949 0.5 . . . . 0.0 110.03 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . 0.511 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -134.5 129.73 35.6 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.337 -174.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -134.19 133.29 40.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 122.4 -0.187 . . . . 0.0 110.508 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.61 110.98 12.88 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 59' ' ' LEU . 60.9 tp -108.07 127.12 53.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 170.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.94 144.73 51.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.093 0.473 . . . . 0.0 110.342 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.3 mtpt -83.75 98.53 9.74 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 169.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.6 p -63.78 139.64 58.79 Favored 'General case' 0 C--O 1.246 0.901 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -64.92 -12.66 51.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.431 1.082 . . . . 0.0 112.331 -176.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.64 -13.36 62.3 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.52 0.728 . . . . 0.0 111.569 171.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.02 37.74 4.56 Favored Glycine 0 C--N 1.349 1.288 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.153 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -132.36 165.25 24.65 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.669 0.388 . . . . 0.0 110.402 -175.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HB3' HD11 ' A' ' 51' ' ' LEU . 76.1 mt -100.97 142.3 32.64 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.725 0.81 . . . . 0.0 109.158 167.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.4 tp -130.97 104.18 6.97 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -93.29 101.59 13.84 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.5 p -115.91 152.44 33.44 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.563 1.145 . . . . 0.0 109.355 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.422 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.785 0.834 . . . . 0.0 108.802 -177.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 108.503 -0.925 . . . . 0.0 108.503 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.58 128.91 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.107 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -86.24 79.46 9.07 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.739 0.816 . . . . 0.0 109.94 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -142.42 96.15 2.9 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.93 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.7 mtm105 -85.32 96.95 9.69 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.212 0.53 . . . . 0.0 109.937 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -112.8 168.6 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.375 1.07 . . . . 0.0 108.899 171.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -57.26 159.51 4.52 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.512 0.725 . . . . 0.0 111.758 177.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.9 p -56.85 -27.39 60.26 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.901 0.88 . . . . 0.0 111.544 168.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.94 -37.3 76.4 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.863 0.865 . . . . 0.0 110.884 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -106.26 37.09 2.37 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.666 0.786 . . . . 0.0 110.869 174.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.524 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -49.55 -20.29 0.73 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' LEU . . . . . 0.531 HD13 ' HD2' ' A' ' 53' ' ' LYS . 94.6 mt -126.22 -42.6 1.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.13 0.572 . . . . 0.0 110.299 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.66 -158.9 43.18 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.993 -176.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -79.07 -4.99 14.27 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.641 2.227 . . . . 0.0 112.189 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.89 -33.52 19.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.582 1.153 . . . . 0.0 110.876 -178.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.65 -4.32 60.83 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.81 -173.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.24 105.07 2.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.692 0.797 . . . . 0.0 110.357 -175.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.9 m -148.55 171.54 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.663 0.785 . . . . 0.0 110.05 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.0 mt -89.5 119.35 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 123.247 0.619 . . . . 0.0 109.799 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.69 137.62 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.498 1.519 . . . . 0.0 109.263 172.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -126.01 122.39 35.74 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 170.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -158.0 110.56 2.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.783 0.433 . . . . 0.0 111.101 -177.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.37 30.94 20.71 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 125.015 1.326 . . . . 0.0 111.6 173.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -18.98 56.49 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.675 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -91.25 128.6 37.13 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.8 135.47 52.97 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.476 0.71 . . . . 0.0 109.97 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -139.01 164.43 29.78 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -103.63 126.62 50.89 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.3 tp -120.36 122.1 40.05 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 170.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -122.12 138.6 54.4 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.638 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -82.72 117.3 22.55 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 171.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.496 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 23.6 p -74.87 147.65 40.88 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -67.14 -12.99 61.51 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.6 -6.54 31.83 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.884 0.874 . . . . 0.0 111.859 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.23 37.94 7.47 Favored Glycine 0 C--N 1.355 1.613 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' LYS . . . . . 0.496 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 54.8 mtpt -136.54 -169.5 2.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.418 0.687 . . . . 0.0 110.405 -171.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LEU . . . . . 0.504 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.6 mt -118.33 166.38 12.7 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.753 1.221 . . . . 0.0 109.979 176.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.5 tp -153.43 103.75 2.69 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -93.99 101.76 13.82 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -177.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.6 p -118.03 133.31 56.03 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.208 1.003 . . . . 0.0 109.861 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.48 1.042 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.9 t -82.58 162.37 21.97 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.505 0.722 . . . . 0.0 110.606 179.845 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 96.1 mtt180 -79.12 136.56 37.17 Favored 'General case' 0 CA--C 1.545 0.769 0 C-N-CA 123.171 0.589 . . . . 0.0 110.108 177.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 4.6 ppp? -94.32 139.67 30.78 Favored 'General case' 0 N--CA 1.474 0.764 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 165.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 -65.79 110.26 2.76 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.571 0.748 . . . . 0.0 112.318 -168.803 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 20.5 p-10 -82.82 162.49 21.63 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 124.151 0.98 . . . . 0.0 109.842 169.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 78.9 m 73.24 114.77 0.06 Allowed 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 125.314 1.446 . . . . 0.0 109.897 -169.759 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -141.16 -171.74 3.34 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.717 0.807 . . . . 0.0 110.485 -173.169 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.3 mp -71.18 138.48 84.52 Favored Pre-proline 0 CA--C 1.55 0.952 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 176.153 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.9 Cg_endo -70.07 168.45 21.92 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 123.034 2.489 . . . . 0.0 112.919 -176.31 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 33.3 m170 -70.23 158.58 87.18 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 123.479 0.712 . . . . 0.0 110.916 177.483 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_exo -48.17 135.16 24.88 Favored 'Trans proline' 0 C--N 1.382 2.328 0 C-N-CA 123.691 2.927 . . . . 0.0 114.753 178.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.6 tpmt? -94.66 159.98 14.83 Favored 'General case' 0 N--CA 1.476 0.846 0 C-N-CA 124.189 0.996 . . . . 0.0 110.194 178.285 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 mp0 -69.86 95.38 0.91 Allowed 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 123.348 0.659 . . . . 0.0 109.491 172.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.8 mt -117.16 23.08 5.52 Favored 'Isoleucine or valine' 0 CA--C 1.567 1.629 0 CA-C-O 122.806 1.289 . . . . 0.0 108.892 178.281 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.8 t0 -142.98 139.73 30.77 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.31 1.044 . . . . 0.0 108.796 177.145 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 14.5 m120 -140.87 31.78 1.8 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.299 0.639 . . . . 0.0 111.467 -172.502 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -72.41 111.83 7.94 Favored 'General case' 0 CA--C 1.551 0.995 0 N-CA-C 109.044 -0.724 . . . . 0.0 109.044 170.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.9 m -84.92 140.8 30.84 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.531 0.733 . . . . 0.0 110.521 -175.024 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 67.2 mt -68.5 150.1 48.47 Favored 'General case' 0 N--CA 1.473 0.678 0 O-C-N 123.4 0.437 . . . . 0.0 110.053 176.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 92.3 mt -86.97 151.93 52.71 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-N 115.057 -0.974 . . . . 0.0 109.468 -176.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 64.2 Cg_exo -54.19 152.14 26.03 Favored 'Trans proline' 0 C--N 1.386 2.5 0 C-N-CA 123.06 2.507 . . . . 0.0 113.563 179.903 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.73 -33.11 71.22 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.196 0.599 . . . . 0.0 110.952 176.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.98 155.4 20.94 Favored 'General case' 0 N--CA 1.467 0.386 0 O-C-N 124.299 0.999 . . . . 0.0 109.243 173.033 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -108.49 23.32 14.7 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.806 0.842 . . . . 0.0 110.11 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.525 ' HG3' HG13 ' A' ' 28' ' ' VAL . 17.6 tpp180 -88.55 95.98 10.45 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 123.375 0.67 . . . . 0.0 110.721 -176.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -78.57 90.22 4.52 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 122.863 0.465 . . . . 0.0 110.038 174.605 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.525 HG13 ' HG3' ' A' ' 26' ' ' ARG . 16.4 m -103.28 152.78 5.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.028 0 C-N-CA 123.628 0.771 . . . . 0.0 109.438 170.065 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 54.9 t30 -62.02 157.13 19.49 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.583 0.753 . . . . 0.0 111.73 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.562 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 31.5 t -44.44 -40.59 5.62 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 125.962 1.705 . . . . 0.0 115.278 -174.73 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 5.3 pm0 -64.22 -27.68 69.22 Favored 'General case' 0 N--CA 1.489 1.508 0 CA-C-N 118.356 0.525 . . . . 0.0 111.44 -175.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -98.78 30.86 3.15 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.338 1.055 . . . . 0.0 111.007 177.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -48.3 -27.7 2.68 Favored 'General case' 0 N--CA 1.493 1.709 0 C-N-CA 125.088 1.355 . . . . 0.0 114.439 -179.849 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 97.6 mt -132.03 -53.27 0.98 Allowed 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.447 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.2 -146.55 50.42 Favored Glycine 0 CA--C 1.53 0.992 0 CA-C-N 114.88 -1.054 . . . . 0.0 111.848 -172.519 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 62.9 Cg_endo -86.31 -2.85 8.62 Favored 'Trans proline' 0 C--N 1.371 1.726 0 C-N-CA 122.582 2.188 . . . . 0.0 112.376 168.757 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.9 t70 -80.74 -60.1 2.43 Favored 'General case' 0 C--N 1.354 0.786 0 C-N-CA 123.822 0.849 . . . . 0.0 110.394 -176.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.28 -28.85 12.25 Favored Glycine 0 C--N 1.349 1.259 0 CA-C-O 119.662 -0.521 . . . . 0.0 114.37 176.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.475 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -134.43 95.42 3.38 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-N 118.109 0.954 . . . . 0.0 111.387 -177.304 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -143.11 161.36 17.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.942 0 C-N-CA 123.396 0.678 . . . . 0.0 110.037 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.535 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 34.4 mt -89.72 124.83 42.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.842 0 C-N-CA 123.183 0.593 . . . . 0.0 109.62 174.448 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.513 HG23 ' HA ' ' A' ' 30' ' ' SER . 1.3 mp -81.86 119.45 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.366 0 C-N-CA 125.135 1.374 . . . . 0.0 109.438 -178.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -96.24 109.44 21.92 Favored 'General case' 0 C--O 1.245 0.845 0 N-CA-C 106.959 -1.497 . . . . 0.0 106.959 175.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.562 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 49.6 t-80 -165.35 148.28 8.01 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.9 0.88 . . . . 0.0 109.872 -174.135 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 8.8 t30 69.04 23.48 6.54 Favored 'General case' 0 CA--C 1.559 1.313 0 C-N-CA 124.396 1.079 . . . . 0.0 111.142 171.319 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 69.48 24.32 76.19 Favored Glycine 0 C--N 1.347 1.144 0 CA-C-N 116.107 -0.497 . . . . 0.0 111.909 -174.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 79.4 mt-30 -138.6 177.98 7.49 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.855 1.262 . . . . 0.0 109.494 -175.767 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.419 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -134.32 149.34 50.87 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.765 0.826 . . . . 0.0 108.866 169.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.677 ' HB3' ' HD2' ' A' ' 63' ' ' LYS . 3.6 p90 -158.84 125.59 4.71 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 123.493 0.717 . . . . 0.0 111.159 176.639 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -75.24 115.83 15.31 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.184 0.994 . . . . 0.0 109.843 -172.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.517 HD11 ' HB3' ' A' ' 59' ' ' LEU . 55.7 tp -109.97 124.39 51.34 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 107.923 -1.14 . . . . 0.0 107.923 169.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 8.0 ptm180 -129.93 152.21 49.65 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 115.981 -0.554 . . . . 0.0 111.027 -179.743 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -90.56 108.31 19.72 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 108.304 -0.999 . . . . 0.0 108.304 168.951 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.8 p -72.57 136.63 45.85 Favored 'General case' 0 C--O 1.248 0.975 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 173.749 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -60.25 -27.23 67.06 Favored 'General case' 0 N--CA 1.491 1.589 0 C-N-CA 124.177 0.991 . . . . 0.0 112.218 -174.095 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -58.46 -22.79 55.85 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.186 0.994 . . . . 0.0 112.039 175.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.51 41.31 0.96 Allowed Glycine 0 C--N 1.346 1.118 0 CA-C-N 115.532 -0.758 . . . . 0.0 112.626 172.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.2 mtmt -137.01 172.68 12.65 Favored 'General case' 0 N--CA 1.49 1.544 0 CA-C-O 121.318 0.58 . . . . 0.0 111.79 -177.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.517 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.8 mt -106.84 148.26 28.74 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.626 -1.17 . . . . 0.0 109.158 169.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.9 tp -137.92 99.59 3.94 Favored 'General case' 0 CA--C 1.542 0.643 0 N-CA-C 108.863 -0.792 . . . . 0.0 108.863 -176.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -89.69 122.47 32.83 Favored 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 107.315 -1.365 . . . . 0.0 107.315 177.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.6 p -135.16 131.66 37.07 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 123.615 0.766 . . . . 0.0 109.766 -174.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.677 ' HD2' ' HB3' ' A' ' 49' ' ' TYR . 30.3 mmmt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.261 1.024 . . . . 0.0 108.701 169.741 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.404 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.49 1.539 0 N-CA-C 110.644 -0.132 . . . . 0.0 110.644 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.4 m -69.25 86.09 0.4 Allowed 'General case' 0 C--N 1.357 0.935 0 C-N-CA 123.72 0.808 . . . . 0.0 111.611 -174.968 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 36.9 mtm180 -133.52 -41.44 0.87 Allowed 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 125.095 1.358 . . . . 0.0 108.526 178.77 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 14.8 tpt 65.32 -101.43 0.08 Allowed 'General case' 0 CA--C 1.548 0.881 0 C-N-CA 125.933 1.693 . . . . 0.0 109.462 -171.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 37.3 t70 172.86 75.44 0.0 OUTLIER 'General case' 0 N--CA 1.481 1.115 0 C-N-CA 124.852 1.261 . . . . 0.0 107.784 -179.435 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 27.0 t-20 66.57 132.54 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.667 0 C-N-CA 125.199 1.399 . . . . 0.0 111.844 -175.214 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 52.0 m -137.11 113.73 10.26 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 121.924 -0.485 . . . . 0.0 109.978 175.937 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -156.94 163.3 39.29 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.997 0.919 . . . . 0.0 109.975 179.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.2 mt -114.47 152.01 45.72 Favored Pre-proline 0 N--CA 1.48 1.056 0 C-N-CA 123.362 0.665 . . . . 0.0 110.466 178.045 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_exo -65.75 147.63 85.89 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 122.755 2.303 . . . . 0.0 111.779 175.381 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.9 m170 -83.59 139.64 41.07 Favored Pre-proline 0 CA--C 1.552 1.028 0 CA-C-O 118.927 -0.558 . . . . 0.0 110.158 179.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 92.7 Cg_exo -46.92 131.33 16.71 Favored 'Trans proline' 0 C--N 1.382 2.305 0 C-N-CA 124.084 3.189 . . . . 0.0 114.449 177.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 1.8 tmtp? -89.39 125.69 35.25 Favored 'General case' 0 N--CA 1.478 0.943 0 C-N-CA 124.529 1.132 . . . . 0.0 109.337 -179.942 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -88.99 144.03 26.44 Favored 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 109.785 -0.45 . . . . 0.0 109.785 177.603 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 55.0 mt -105.55 76.1 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.914 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 -179.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 25.4 t70 63.56 170.78 0.16 Allowed 'General case' 0 N--CA 1.494 1.75 0 C-N-CA 124.719 1.208 . . . . 0.0 112.973 170.938 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 46.7 t30 -155.23 144.5 21.04 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.274 1.029 . . . . 0.0 109.236 170.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -130.8 -49.91 1.04 Allowed 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.404 0.682 . . . . 0.0 110.071 178.51 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.6 t -69.25 143.7 53.84 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.68 0.792 . . . . 0.0 112.585 -172.051 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 87.5 mt -81.06 163.75 22.97 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.875 0.87 . . . . 0.0 109.428 168.749 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 86.4 mt -91.7 138.68 24.96 Favored Pre-proline 0 N--CA 1.475 0.806 0 CA-C-N 115.974 -0.557 . . . . 0.0 110.019 -179.738 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 39.6 Cg_exo -59.17 139.41 90.24 Favored 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.667 2.245 . . . . 0.0 111.776 177.181 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.514 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -55.87 -34.69 65.72 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.887 0.875 . . . . 0.0 111.488 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.39 159.04 19.22 Favored 'General case' 0 C--O 1.242 0.703 0 C-N-CA 124.798 1.239 . . . . 0.0 108.95 171.459 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -114.12 22.49 13.79 Favored 'General case' 0 N--CA 1.479 1.013 0 CA-C-O 121.311 0.577 . . . . 0.0 109.865 171.408 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 10.2 tpp180 -85.47 103.22 14.15 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-N 115.101 -0.954 . . . . 0.0 110.11 178.343 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 10.8 mpt_? -79.75 107.82 12.82 Favored 'General case' 0 N--CA 1.475 0.782 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 172.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 22.5 m -122.56 153.17 27.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.939 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 169.008 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.9 m-80 -62.75 164.75 7.4 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 122.968 0.507 . . . . 0.0 111.932 -174.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 16.2 m -55.35 -33.76 63.66 Favored 'General case' 0 N--CA 1.491 1.615 0 C-N-CA 123.934 0.894 . . . . 0.0 112.916 -178.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -58.87 -32.47 69.51 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 124.155 0.982 . . . . 0.0 111.776 176.049 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -105.04 31.25 4.96 Favored 'General case' 0 CA--C 1.55 0.943 0 C-N-CA 124.576 1.15 . . . . 0.0 111.443 179.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.461 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.5 pt? -45.51 -24.64 0.34 Allowed 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 116.433 2.012 . . . . 0.0 116.433 -174.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.53 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 82.4 mt -123.05 -58.52 1.64 Allowed 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.658 0.663 . . . . 0.0 111.227 179.776 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 75.71 -155.36 46.57 Favored Glycine 0 CA--C 1.529 0.938 0 O-C-N 123.849 0.718 . . . . 0.0 112.906 -176.134 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_endo -73.64 -16.03 24.11 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 123.023 2.482 . . . . 0.0 112.001 172.365 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -79.63 -54.51 5.81 Favored 'General case' 0 C--N 1.344 0.367 0 C-N-CA 124.27 1.028 . . . . 0.0 110.73 -178.41 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.53 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 82.47 3.48 90.51 Favored Glycine 0 CA--C 1.529 0.937 0 CA-C-N 115.26 -0.882 . . . . 0.0 112.482 -171.5 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.514 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 0.0 OUTLIER -147.96 89.58 1.75 Allowed 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 124.203 1.001 . . . . 0.0 110.009 -177.26 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 20.6 m -145.35 170.8 5.94 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.416 0 C-N-CA 123.787 0.835 . . . . 0.0 110.537 -176.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 26.0 mt -94.33 112.31 26.81 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.845 0 C-N-CA 123.409 0.683 . . . . 0.0 109.913 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.474 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -70.8 115.89 11.29 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 C-N-CA 125.754 1.621 . . . . 0.0 110.476 178.572 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 16.0 t70 -93.44 104.05 16.22 Favored 'General case' 0 C--O 1.242 0.671 0 N-CA-C 107.821 -1.178 . . . . 0.0 107.821 171.345 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 32.4 t60 -102.63 86.53 2.79 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.612 -1.255 . . . . 0.0 107.612 168.06 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 18.0 m120 55.08 55.46 7.63 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.175 1.39 . . . . 0.0 111.329 176.602 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 91.9 -26.33 13.25 Favored Glycine 0 N--CA 1.469 0.848 0 CA-C-N 114.771 -1.104 . . . . 0.0 113.682 -179.673 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.4 mt-30 -82.37 106.05 13.93 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 -177.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 10.2 pt-20 -101.8 124.48 47.52 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 123.211 0.604 . . . . 0.0 111.443 -171.507 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.656 ' HB3' ' HB3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -136.32 135.34 38.82 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.914 0.886 . . . . 0.0 109.633 178.192 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -78.26 129.55 35.2 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 -178.451 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.631 HD11 ' HB3' ' A' ' 59' ' ' LEU . 61.0 tp -122.98 136.63 54.93 Favored 'General case' 0 N--CA 1.477 0.915 0 N-CA-C 108.227 -1.027 . . . . 0.0 108.227 171.606 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -141.09 142.63 34.11 Favored 'General case' 0 N--CA 1.478 0.931 0 O-C-N 123.365 0.416 . . . . 0.0 111.796 -177.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -78.69 102.83 8.25 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 123.348 0.659 . . . . 0.0 109.497 174.022 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -73.47 133.75 43.74 Favored 'General case' 0 C--O 1.253 1.279 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 174.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 50.8 tt0 -70.47 -8.25 49.63 Favored 'General case' 0 N--CA 1.483 1.219 0 O-C-N 124.011 0.82 . . . . 0.0 110.702 179.135 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -61.92 -18.29 59.77 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.562 1.145 . . . . 0.0 111.718 167.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.51 34.35 3.89 Favored Glycine 0 C--N 1.344 0.973 0 C-N-CA 123.414 0.53 . . . . 0.0 112.74 177.643 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.1 mtmt -144.08 175.22 10.21 Favored 'General case' 0 N--CA 1.494 1.73 0 CA-C-O 121.334 0.588 . . . . 0.0 111.47 -175.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.631 ' HB3' HD11 ' A' ' 51' ' ' LEU . 30.8 mt -106.86 146.97 30.32 Favored 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 124.751 1.221 . . . . 0.0 108.858 165.537 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.9 tp -132.86 102.23 5.56 Favored 'General case' 0 C--O 1.243 0.745 0 C-N-CA 123.407 0.683 . . . . 0.0 109.203 -175.883 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -88.94 103.23 15.84 Favored 'General case' 0 CA--C 1.54 0.591 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 176.518 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 43.8 p -109.03 135.02 50.87 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.303 1.041 . . . . 0.0 109.674 175.374 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.656 ' HB3' ' HB3' ' A' ' 49' ' ' TYR . 22.6 pttm . . . . . 0 N--CA 1.478 0.955 0 C-N-CA 123.65 0.78 . . . . 0.0 110.326 -176.046 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.9 mtp . . . . . 0 N--CA 1.478 0.964 0 N-CA-C 110.137 -0.32 . . . . 0.0 110.137 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m 60.02 88.62 0.07 Allowed 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.9 1.28 . . . . 0.0 112.707 175.173 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 64.3 ttt180 -116.4 84.17 2.08 Favored 'General case' 0 N--CA 1.475 0.798 0 N-CA-C 109.392 -0.596 . . . . 0.0 109.392 177.185 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.8 ttt -120.19 125.69 48.79 Favored 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 123.704 0.801 . . . . 0.0 109.104 173.819 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -149.06 142.87 25.64 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.081 -1.081 . . . . 0.0 108.081 175.404 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.3 p-10 -145.54 46.98 1.29 Allowed 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.224 0.61 . . . . 0.0 110.501 -173.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 15.5 p -62.57 86.18 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.808 -0.633 . . . . 0.0 111.232 173.54 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.8 mt-10 -130.53 168.91 16.29 Favored 'General case' 0 C--O 1.241 0.634 0 C-N-CA 124.727 1.211 . . . . 0.0 108.718 177.252 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.1 mp -67.92 126.39 92.57 Favored Pre-proline 0 N--CA 1.479 0.976 0 C-N-CA 123.514 0.726 . . . . 0.0 109.824 179.01 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 22.6 Cg_exo -68.3 63.0 1.09 Allowed 'Trans proline' 0 C--N 1.382 2.295 0 C-N-CA 123.824 3.016 . . . . 0.0 112.924 170.418 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 1.5 m-70 -146.13 136.31 12.01 Favored Pre-proline 0 C--O 1.243 0.748 0 C-N-CA 125.79 1.636 . . . . 0.0 106.969 178.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.9 165.8 26.75 Favored 'Trans proline' 0 C--N 1.366 1.466 0 C-N-CA 122.124 1.883 . . . . 0.0 111.239 174.209 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 25.6 mtpp -78.92 81.01 5.24 Favored 'General case' 0 C--O 1.239 0.515 0 N-CA-C 108.855 -0.795 . . . . 0.0 108.855 177.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -69.48 116.3 9.73 Favored 'General case' 0 CA--C 1.537 0.446 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.465 -176.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 79.3 mt -74.23 91.64 0.66 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.808 0.813 . . . . 0.0 109.174 -179.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.9 t70 -128.74 93.83 3.71 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-N 114.554 -1.203 . . . . 0.0 108.211 -178.784 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 44.0 t30 -96.01 119.01 33.74 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.391 -0.822 . . . . 0.0 109.326 -179.827 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -124.22 39.28 4.01 Favored 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 123.411 0.684 . . . . 0.0 110.235 179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 12.4 t -68.3 155.22 40.21 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 115.829 -0.623 . . . . 0.0 111.096 174.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 82.8 mt -72.12 156.96 38.61 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.159 0.584 . . . . 0.0 111.421 -177.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 93.7 mt -83.15 152.51 65.2 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 115.038 -0.983 . . . . 0.0 110.777 -174.59 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.24 158.88 52.62 Favored 'Trans proline' 0 C--N 1.384 2.442 0 C-N-CA 122.919 2.412 . . . . 0.0 111.808 174.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -79.65 -60.61 2.29 Favored 'General case' 0 N--CA 1.476 0.835 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 -179.199 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.54 149.55 9.87 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.161 -179.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.472 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 35.0 mt-10 -100.45 28.53 4.97 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.962 0.905 . . . . 0.0 111.325 179.801 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 21.3 tpp180 -81.06 92.52 6.24 Favored 'General case' 0 CA--C 1.552 1.044 0 C-N-CA 123.486 0.714 . . . . 0.0 111.099 -177.251 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.472 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 11.1 mpt_? -74.48 106.77 6.24 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.173 -0.677 . . . . 0.0 109.173 174.193 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 11.1 m -140.5 145.99 25.01 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 C-N-CA 124.782 1.233 . . . . 0.0 109.374 177.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HA ' ' O ' ' A' ' 43' ' ' ASP . 59.8 t30 -60.95 159.95 10.58 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.627 0.771 . . . . 0.0 111.336 -178.716 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 59.2 m -43.03 -30.43 0.43 Allowed 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 114.759 1.392 . . . . 0.0 114.759 174.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 36.2 mt-30 -55.49 -42.64 74.69 Favored 'General case' 0 N--CA 1.479 1.01 0 CA-C-O 121.488 0.661 . . . . 0.0 111.175 176.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.94 37.54 1.94 Allowed 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 124.557 1.143 . . . . 0.0 110.841 179.02 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.562 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -54.33 -22.46 12.18 Favored 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 -178.03 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.536 HD13 ' HD2' ' A' ' 53' ' ' LYS . 96.0 mt -134.65 -52.53 0.81 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-O 121.253 0.549 . . . . 0.0 109.554 174.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.67 -152.26 50.33 Favored Glycine 0 C--N 1.345 1.068 0 CA-C-N 115.133 -0.94 . . . . 0.0 112.024 -174.773 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 43.4 Cg_endo -86.35 3.8 6.7 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.83 2.353 . . . . 0.0 112.837 170.03 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -91.13 -58.16 2.56 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.595 0.758 . . . . 0.0 109.873 -176.904 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 106.55 -22.91 29.55 Favored Glycine 0 C--N 1.357 1.733 0 CA-C-O 119.364 -0.686 . . . . 0.0 113.779 178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.7 ptpp? -133.67 101.27 5.05 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-N 118.493 1.147 . . . . 0.0 111.276 -177.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.4 m -142.07 167.83 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.197 0 O-C-N 121.816 -0.552 . . . . 0.0 111.335 -176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.435 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 59.8 mt -92.68 111.62 24.75 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.47 1.108 . . . . 0.0 108.868 173.46 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.562 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -80.77 111.24 17.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 C-N-CA 124.162 0.985 . . . . 0.0 109.663 -179.759 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.423 ' O ' ' HA ' ' A' ' 29' ' ' ASN . 19.3 t70 -89.11 122.13 32.12 Favored 'General case' 0 C--N 1.321 -0.636 0 C-N-CA 124.885 1.274 . . . . 0.0 107.935 174.163 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 6.0 t-80 -171.48 143.55 1.8 Allowed 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.276 0.63 . . . . 0.0 110.723 175.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 6.0 t30 62.92 21.34 12.81 Favored 'General case' 0 CA--C 1.561 1.388 0 C-N-CA 124.696 1.198 . . . . 0.0 112.18 170.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 92.06 -4.49 78.01 Favored Glycine 0 C--N 1.35 1.308 0 O-C-N 121.872 -0.517 . . . . 0.0 113.527 178.089 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.8 mt-30 -120.26 171.7 8.31 Favored 'General case' 0 N--CA 1.48 1.056 0 CA-C-O 121.718 0.771 . . . . 0.0 111.512 179.153 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.435 ' HB2' ' CG2' ' A' ' 41' ' ' ILE . 1.0 OUTLIER -129.82 137.73 50.62 Favored 'General case' 0 C--O 1.241 0.657 0 CA-C-N 114.352 -1.295 . . . . 0.0 109.294 179.556 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.509 ' HD1' ' HE3' ' A' ' 63' ' ' LYS . 0.0 OUTLIER -137.18 118.1 14.23 Favored 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 123.513 0.725 . . . . 0.0 109.087 -178.723 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -76.5 103.41 6.48 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.426 0.69 . . . . 0.0 109.235 179.35 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.462 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -104.68 118.74 37.33 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 107.867 -1.16 . . . . 0.0 107.867 176.335 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.4 ptm180 -123.85 134.51 53.57 Favored 'General case' 0 CA--C 1.541 0.605 0 O-C-N 123.764 0.665 . . . . 0.0 109.859 -179.567 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.536 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.6 mtpm? -79.31 99.25 7.02 Favored 'General case' 0 C--O 1.242 0.691 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 173.187 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -62.69 136.62 57.97 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 108.231 -1.026 . . . . 0.0 108.231 176.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.8 tt0 -70.42 -4.83 24.42 Favored 'General case' 0 CA--C 1.554 1.108 0 C-N-CA 123.636 0.774 . . . . 0.0 111.704 -177.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.35 -11.84 60.17 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.57 1.148 . . . . 0.0 112.071 166.06 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 92.58 40.07 5.13 Favored Glycine 0 C--N 1.347 1.142 0 C-N-CA 123.539 0.59 . . . . 0.0 112.289 179.836 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.1 mtmt -140.89 170.84 14.99 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 122.87 0.468 . . . . 0.0 110.726 -175.599 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.462 ' HB3' HD11 ' A' ' 51' ' ' LEU . 72.1 mt -106.78 139.73 40.74 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.479 1.112 . . . . 0.0 109.498 172.795 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -127.12 100.95 6.32 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 -179.914 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -89.82 113.79 25.41 Favored 'General case' 0 C--O 1.238 0.492 0 N-CA-C 107.249 -1.389 . . . . 0.0 107.249 178.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 81.5 p -130.31 -179.12 5.07 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.972 1.309 . . . . 0.0 108.17 179.788 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HE3' ' HD1' ' A' ' 49' ' ' TYR . 46.1 mmtm . . . . . 0 C--O 1.251 1.168 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 174.268 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.9 ptt? . . . . . 0 N--CA 1.486 1.357 0 CA-C-O 120.747 0.308 . . . . 0.0 111.362 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 53.3 p -150.22 133.22 16.13 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.278 0.631 . . . . 0.0 109.898 179.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 10.4 mpt_? -80.19 146.97 31.48 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.275 0.63 . . . . 0.0 111.191 178.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.43 ' N ' ' SD ' ' A' ' 4' ' ' MET . 1.5 mpt? -100.44 72.8 1.61 Allowed 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 107.772 -1.195 . . . . 0.0 107.772 171.573 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 7.7 p-10 -80.01 -7.29 58.76 Favored 'General case' 0 N--CA 1.486 1.372 0 CA-C-N 115.47 -0.786 . . . . 0.0 112.377 -173.906 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.8 p-10 -55.77 127.63 31.03 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.946 0.898 . . . . 0.0 111.531 176.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.6 t -160.69 125.26 3.66 Favored 'General case' 0 CA--C 1.55 0.973 0 C-N-CA 123.777 0.831 . . . . 0.0 109.656 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -124.49 90.57 3.28 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.769 0.827 . . . . 0.0 109.798 -178.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -74.04 161.51 78.14 Favored Pre-proline 0 CA--C 1.556 1.201 0 CA-C-O 118.424 -0.798 . . . . 0.0 110.273 176.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_exo -40.77 139.22 1.35 Allowed 'Trans proline' 0 C--N 1.393 2.876 0 C-N-CA 123.905 3.07 . . . . 0.0 114.267 174.928 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 51.5 p-80 -162.17 166.06 14.77 Favored Pre-proline 0 N--CA 1.482 1.141 0 C-N-CA 124.263 1.025 . . . . 0.0 110.174 -166.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_exo -51.09 141.54 37.66 Favored 'Trans proline' 0 C--N 1.387 2.553 0 C-N-CA 123.151 2.568 . . . . 0.0 114.384 173.348 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -73.84 135.6 43.43 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 123.531 0.732 . . . . 0.0 110.995 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.4 mp0 -66.46 114.37 5.4 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 124.213 1.005 . . . . 0.0 111.361 -173.279 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.3 mt -98.71 94.83 3.91 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.021 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 172.484 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.1 t70 -95.62 148.58 22.38 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.268 0.627 . . . . 0.0 109.996 179.951 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 35.9 m-80 -74.62 87.27 2.15 Favored 'General case' 0 N--CA 1.474 0.737 0 CA-C-O 121.062 0.458 . . . . 0.0 109.967 -179.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -7.36 59.55 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.741 0.816 . . . . 0.0 110.854 177.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 27.3 m -52.08 128.6 25.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 125.181 1.392 . . . . 0.0 112.505 -175.205 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.0 mt -73.68 158.6 34.39 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.693 0.797 . . . . 0.0 110.878 -177.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mp -88.63 149.26 43.73 Favored Pre-proline 0 CA--C 1.546 0.799 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.617 -178.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -64.28 150.38 88.41 Favored 'Trans proline' 0 C--N 1.382 2.322 0 C-N-CA 122.816 2.344 . . . . 0.0 111.565 178.443 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.11 -54.14 45.49 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 122.727 0.411 . . . . 0.0 110.377 -178.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.63 149.23 26.39 Favored 'General case' 0 N--CA 1.469 0.523 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.841 177.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -111.43 24.13 13.17 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.721 0.808 . . . . 0.0 109.366 171.104 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 13.9 tpp85 -83.31 90.24 7.11 Favored 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 124.177 0.991 . . . . 0.0 110.123 -178.277 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -77.58 96.49 4.8 Favored 'General case' 0 N--CA 1.474 0.757 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 174.43 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 8.2 m -119.99 156.45 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.137 0 C-N-CA 124.431 1.092 . . . . 0.0 109.198 171.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 55.4 t30 -59.27 155.74 13.83 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 123.941 0.896 . . . . 0.0 111.048 -177.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 22.8 t -51.93 -26.81 11.15 Favored 'General case' 0 CA--C 1.56 1.346 0 C-N-CA 124.631 1.172 . . . . 0.0 113.584 -178.823 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.4 pt20 -58.6 -35.83 73.05 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 123.445 0.698 . . . . 0.0 111.701 176.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.71 40.63 1.67 Allowed 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.946 0.898 . . . . 0.0 109.908 177.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -47.17 -16.67 0.05 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 115.7 1.741 . . . . 0.0 115.7 177.188 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.526 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.1 mt -119.17 -32.18 4.48 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 121.728 -0.608 . . . . 0.0 110.636 174.803 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.25 -166.26 37.89 Favored Glycine 0 CA--C 1.535 1.289 0 CA-C-N 115.888 -0.596 . . . . 0.0 112.958 -177.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -76.21 -10.32 19.26 Favored 'Trans proline' 0 C--N 1.369 1.627 0 C-N-CA 122.631 2.22 . . . . 0.0 112.097 173.853 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.1 m-20 -91.65 -24.12 19.63 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.785 0.834 . . . . 0.0 110.625 -175.496 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.46 -6.29 73.6 Favored Glycine 0 C--N 1.35 1.357 0 O-C-N 123.165 0.291 . . . . 0.0 112.592 -175.909 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.63 110.2 3.8 Favored 'General case' 0 C--O 1.236 0.367 0 C-N-CA 124.136 0.974 . . . . 0.0 108.956 -177.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.2 m -146.75 171.89 3.48 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.22 0 C-N-CA 123.448 0.699 . . . . 0.0 110.742 -176.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 57.6 mt -92.54 116.12 32.97 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.092 0 CA-C-N 115.656 -0.702 . . . . 0.0 109.457 171.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.46 136.11 27.1 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 125.21 1.404 . . . . 0.0 109.505 174.064 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.6 t70 -115.03 118.34 33.13 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 124.406 1.082 . . . . 0.0 108.404 172.178 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 67.7 t60 -152.45 113.81 4.27 Favored 'General case' 0 N--CA 1.473 0.682 0 O-C-N 123.458 0.473 . . . . 0.0 111.065 178.437 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.5 t30 63.54 28.9 15.34 Favored 'General case' 0 CA--C 1.559 1.326 0 C-N-CA 124.821 1.248 . . . . 0.0 111.044 171.779 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.51 2.55 87.15 Favored Glycine 0 C--N 1.349 1.293 0 CA-C-N 115.452 -0.794 . . . . 0.0 114.003 179.748 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 81.4 mm-40 -111.02 128.57 55.9 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.838 0.855 . . . . 0.0 109.086 179.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.468 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 15.4 pt-20 -113.02 137.82 50.82 Favored 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.284 0.634 . . . . 0.0 110.957 -175.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER -135.31 149.53 49.78 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 108.555 -0.906 . . . . 0.0 108.555 -178.348 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -100.35 109.51 21.69 Favored 'General case' 0 N--CA 1.488 1.448 0 CA-C-N 118.854 0.752 . . . . 0.0 109.071 177.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.493 HD11 ' HB3' ' A' ' 59' ' ' LEU . 51.0 tp -107.34 125.85 51.72 Favored 'General case' 0 N--CA 1.48 1.054 0 N-CA-C 108.052 -1.092 . . . . 0.0 108.052 174.17 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.09 135.66 48.48 Favored 'General case' 0 C--O 1.237 0.436 0 O-C-N 123.915 0.76 . . . . 0.0 110.54 -177.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.526 ' HD2' HD13 ' A' ' 34' ' ' LEU . 62.0 mtpt -77.01 108.01 9.77 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.541 -0.911 . . . . 0.0 108.541 169.744 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -72.29 139.53 48.07 Favored 'General case' 0 C--O 1.249 1.039 0 N-CA-C 107.435 -1.32 . . . . 0.0 107.435 174.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -74.07 -4.72 37.24 Favored 'General case' 0 N--CA 1.482 1.156 0 O-C-N 123.7 0.625 . . . . 0.0 111.015 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -64.8 -23.85 67.37 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.608 0.763 . . . . 0.0 110.789 165.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 109.1 36.99 2.05 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.424 -0.807 . . . . 0.0 112.349 177.852 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 44.0 mtmt -134.12 177.66 7.57 Favored 'General case' 0 N--CA 1.486 1.334 0 CA-C-O 121.313 0.578 . . . . 0.0 111.413 -174.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.493 ' HB3' HD11 ' A' ' 51' ' ' LEU . 89.6 mt -114.07 138.86 49.84 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 125.135 1.374 . . . . 0.0 108.35 169.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.6 tp -133.28 102.27 5.49 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.399 -0.593 . . . . 0.0 109.399 -174.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -86.06 121.8 29.18 Favored 'General case' 0 N--CA 1.478 0.928 0 N-CA-C 107.983 -1.117 . . . . 0.0 107.983 176.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 70.9 p -130.49 158.62 39.44 Favored 'General case' 0 C--O 1.241 0.614 0 C-N-CA 123.996 0.918 . . . . 0.0 109.643 -177.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.7 mmmt . . . . . 0 C--O 1.25 1.12 0 C-N-CA 124.157 0.983 . . . . 0.0 109.01 -177.777 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.0 mtt . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 108.993 -0.743 . . . . 0.0 108.993 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 23.7 m -74.54 90.17 2.22 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.841 -0.618 . . . . 0.0 110.142 -178.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -166.75 137.01 3.15 Favored 'General case' 0 C--N 1.35 0.608 0 C-N-CA 124.06 0.944 . . . . 0.0 110.293 -179.999 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.47 ' HG3' ' HG2' ' A' ' 8' ' ' GLU . 15.2 ptp -159.66 92.0 1.02 Allowed 'General case' 0 N--CA 1.476 0.844 0 N-CA-C 108.308 -0.997 . . . . 0.0 108.308 179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.5 t70 55.14 57.31 5.64 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 124.393 1.077 . . . . 0.0 108.631 -166.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 38.7 t30 61.46 -80.71 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.95 0 CA-C-N 114.062 -1.426 . . . . 0.0 108.833 -163.02 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.0 m -150.4 103.38 3.14 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 124.138 0.975 . . . . 0.0 108.529 171.491 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.47 ' HG2' ' HG3' ' A' ' 4' ' ' MET . 10.2 pt-20 -75.12 111.06 9.96 Favored 'General case' 0 CA--C 1.547 0.847 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 173.19 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -135.35 79.55 48.54 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 123.347 0.659 . . . . 0.0 112.151 -176.76 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -80.83 -174.52 2.27 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 122.718 2.278 . . . . 0.0 111.267 169.298 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 37.2 m80 -81.82 118.26 71.44 Favored Pre-proline 0 CA--C 1.549 0.932 0 N-CA-C 109.431 -0.581 . . . . 0.0 109.431 177.925 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 40.0 Cg_endo -65.84 99.76 0.4 Allowed 'Trans proline' 0 C--N 1.379 2.18 0 C-N-CA 122.944 2.43 . . . . 0.0 112.649 -178.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -67.43 -67.31 0.47 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.103 -0.953 . . . . 0.0 108.91 171.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.8 tt0 -178.62 110.48 0.06 Allowed 'General case' 0 N--CA 1.47 0.526 0 C-N-CA 124.997 1.319 . . . . 0.0 108.511 173.106 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 27.5 mt -95.52 69.21 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.935 0 N-CA-C 107.599 -1.26 . . . . 0.0 107.599 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 29.4 t70 -168.6 161.57 11.52 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.159 -1.382 . . . . 0.0 108.635 -178.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -144.37 97.51 3.05 Favored 'General case' 0 C--O 1.241 0.65 0 C-N-CA 123.115 0.566 . . . . 0.0 110.353 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -143.73 114.37 7.61 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 163.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.0 m -80.22 85.98 5.68 Favored 'General case' 0 N--CA 1.476 0.84 0 CA-C-O 121.694 0.759 . . . . 0.0 110.66 -171.71 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 79.2 mt -85.35 167.85 15.19 Favored 'General case' 0 N--CA 1.475 0.815 0 CA-C-N 114.81 -1.087 . . . . 0.0 109.947 176.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.3 mp 69.21 139.94 0.07 OUTLIER Pre-proline 0 N--CA 1.493 1.675 0 C-N-CA 124.305 1.042 . . . . 0.0 112.084 -179.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -65.55 132.94 32.63 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 122.082 1.855 . . . . 0.0 110.129 168.144 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.59 -37.81 58.85 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 123.744 0.818 . . . . 0.0 112.496 -176.704 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.58 -172.72 2.51 Favored 'General case' 0 C--O 1.24 0.595 0 O-C-N 124.446 1.092 . . . . 0.0 110.398 175.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -120.25 27.17 8.77 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 124.323 1.049 . . . . 0.0 109.95 -178.158 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 18.7 tpp180 -72.63 76.64 1.09 Allowed 'General case' 0 CA--C 1.548 0.893 0 C-N-CA 124.255 1.022 . . . . 0.0 109.524 179.189 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.42 ' HA ' ' HB ' ' A' ' 41' ' ' ILE . 2.7 ttm180 -82.91 86.23 6.99 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 -171.966 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 35.5 m -113.67 154.0 15.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.727 0 C-N-CA 124.227 1.011 . . . . 0.0 109.763 -175.731 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 46.1 t30 -56.39 152.08 11.97 Favored 'General case' 0 CA--C 1.555 1.168 0 O-C-N 123.716 0.635 . . . . 0.0 111.042 172.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.5 m -50.04 -24.98 2.98 Favored 'General case' 0 N--CA 1.486 1.371 0 N-CA-C 114.433 1.271 . . . . 0.0 114.433 -179.413 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.0 pt20 -58.22 -33.4 69.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 122.729 0.412 . . . . 0.0 111.587 176.982 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.48 35.3 3.12 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 124.456 1.102 . . . . 0.0 110.401 178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -53.62 -19.01 3.4 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 114.357 1.243 . . . . 0.0 114.357 -178.174 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.464 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.0 mt -133.11 -65.91 0.68 Allowed 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.115 -1.068 . . . . 0.0 108.115 168.765 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.0 -155.29 53.15 Favored Glycine 0 CA--C 1.533 1.188 0 CA-C-N 115.685 -0.689 . . . . 0.0 113.465 179.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 71.0 Cg_endo -80.8 2.8 8.28 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 123.035 2.49 . . . . 0.0 112.828 176.204 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 19.1 t70 -97.79 -59.0 1.86 Allowed 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 124.342 1.057 . . . . 0.0 109.465 179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 97.27 -11.16 65.5 Favored Glycine 0 C--N 1.347 1.143 0 N-CA-C 115.3 0.88 . . . . 0.0 115.3 174.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.411 ' HD2' ' O ' ' A' ' 39' ' ' LYS . 0.0 OUTLIER -141.54 78.74 1.65 Allowed 'General case' 0 N--CA 1.487 1.425 0 CA-C-O 122.866 1.317 . . . . 0.0 110.868 -175.839 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 6.4 m -123.98 159.94 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.082 0 CA-C-N 114.606 -1.179 . . . . 0.0 110.773 -168.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.42 ' HB ' ' HA ' ' A' ' 27' ' ' ARG . 50.7 mt -90.15 110.58 22.13 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 N-CA-C 108.437 -0.949 . . . . 0.0 108.437 171.766 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.504 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.35 105.15 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.663 0 C-N-CA 124.634 1.174 . . . . 0.0 109.997 -179.124 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 30.9 t70 -78.3 121.7 24.77 Favored 'General case' 0 C--O 1.248 0.995 0 N-CA-C 108.314 -0.995 . . . . 0.0 108.314 166.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 10.6 t-80 -145.83 100.3 3.39 Favored 'General case' 0 C--O 1.239 0.537 0 O-C-N 124.038 0.836 . . . . 0.0 109.101 -177.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 32.3 m-80 61.61 23.24 13.58 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 125.152 1.381 . . . . 0.0 111.641 -178.417 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.79 -22.35 40.0 Favored Glycine 0 C--N 1.347 1.168 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.653 -177.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 -80.92 111.56 17.5 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.557 -0.905 . . . . 0.0 108.557 177.964 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.504 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.5 pt-20 -104.46 131.27 52.03 Favored 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 123.524 0.729 . . . . 0.0 110.222 -175.88 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HD2' HD21 ' A' ' 61' ' ' LEU . 5.6 p90 -148.52 123.86 10.27 Favored 'General case' 0 N--CA 1.48 1.063 0 C-N-CA 123.124 0.57 . . . . 0.0 111.883 -176.0 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -74.12 110.84 8.74 Favored 'General case' 0 CA--C 1.551 1.011 0 C-N-CA 125.033 1.333 . . . . 0.0 110.061 -175.55 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.565 HD11 ' HB3' ' A' ' 59' ' ' LEU . 53.7 tp -104.37 129.41 52.29 Favored 'General case' 0 N--CA 1.479 1.009 0 N-CA-C 107.748 -1.204 . . . . 0.0 107.748 170.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.0 ptm180 -131.93 133.86 45.01 Favored 'General case' 0 C--O 1.243 0.733 0 O-C-N 123.546 0.529 . . . . 0.0 111.255 -174.47 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.464 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.5 mtpt -85.11 105.0 15.51 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 123.953 0.901 . . . . 0.0 109.491 175.268 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 41.1 p -71.92 145.27 48.59 Favored 'General case' 0 C--O 1.25 1.099 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 171.648 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 49.3 mt-30 -63.3 -20.49 65.53 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 124.708 1.255 . . . . 0.0 112.323 -175.469 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.409 ' HB3' ' HE2' ' A' ' 58' ' ' LYS . . . -64.77 -15.72 62.03 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.819 0.848 . . . . 0.0 111.767 172.786 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.93 37.94 4.78 Favored Glycine 0 C--N 1.342 0.913 0 C-N-CA 124.27 0.938 . . . . 0.0 111.95 179.541 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.409 ' HE2' ' HB3' ' A' ' 56' ' ' ALA . 43.9 mtmt -127.64 161.44 28.86 Favored 'General case' 0 N--CA 1.493 1.697 0 CA-C-O 120.809 0.337 . . . . 0.0 111.417 -173.612 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.565 ' HB3' HD11 ' A' ' 51' ' ' LEU . 48.3 mt -110.34 126.81 54.63 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.993 0.917 . . . . 0.0 110.187 177.295 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 7.0 mp -115.93 114.69 25.0 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 124.747 1.219 . . . . 0.0 108.82 177.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.568 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.8 tm? -102.36 100.4 10.55 Favored 'General case' 0 N--CA 1.472 0.648 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 -178.64 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 44.5 p -105.73 152.82 22.69 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.515 1.126 . . . . 0.0 108.922 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.7 mmtt . . . . . 0 C--O 1.251 1.158 0 C-N-CA 123.13 0.572 . . . . 0.0 109.985 177.857 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.488 1.461 0 N-CA-C 111.559 0.207 . . . . 0.0 111.559 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 25.1 m -69.46 84.44 0.41 Allowed 'General case' 0 CA--C 1.548 0.877 0 C-N-CA 123.476 0.71 . . . . 0.0 109.756 174.384 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 79.7 mtp180 -83.94 77.13 9.97 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 123.342 0.657 . . . . 0.0 110.773 -175.274 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -92.58 102.06 14.49 Favored 'General case' 0 C--N 1.348 0.513 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 169.453 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 27.1 t70 -148.54 119.15 7.46 Favored 'General case' 0 N--CA 1.467 0.382 0 N-CA-C 108.593 -0.892 . . . . 0.0 108.593 177.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 t30 -155.84 146.07 21.63 Favored 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 124.183 0.993 . . . . 0.0 108.957 -177.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -155.63 153.48 30.12 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.384 0.674 . . . . 0.0 109.48 176.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -80.81 104.62 11.45 Favored 'General case' 0 CA--C 1.543 0.699 0 N-CA-C 106.926 -1.509 . . . . 0.0 106.926 171.86 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.6 mt -61.58 111.04 3.72 Favored Pre-proline 0 CA--C 1.555 1.162 0 C-N-CA 124.702 1.201 . . . . 0.0 111.627 -173.517 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 40.1 Cg_endo -93.19 -175.28 0.49 Allowed 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 123.09 2.527 . . . . 0.0 112.336 177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.1 p-80 -158.0 58.37 1.4 Allowed Pre-proline 0 CA--C 1.554 1.127 0 CA-C-N 116.255 -0.429 . . . . 0.0 110.978 172.859 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_exo -65.53 143.98 77.49 Favored 'Trans proline' 0 C--N 1.38 2.189 0 C-N-CA 122.038 1.825 . . . . 0.0 111.115 -179.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 mtpt -73.33 82.36 1.39 Allowed 'General case' 0 CA--C 1.545 0.761 0 CA-C-O 121.199 0.523 . . . . 0.0 109.879 178.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.17 98.1 7.18 Favored 'General case' 0 C--N 1.347 0.46 0 CA-C-N 115.018 -0.992 . . . . 0.0 108.636 -178.818 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 46.2 mt -76.08 78.37 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 121.663 0.744 . . . . 0.0 109.73 -176.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -93.69 -57.08 2.67 Favored 'General case' 0 C--N 1.344 0.334 0 N-CA-C 107.769 -1.197 . . . . 0.0 107.769 171.254 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 63.3 t30 -169.43 22.87 0.02 OUTLIER 'General case' 0 CA--C 1.553 1.07 0 O-C-N 124.339 1.024 . . . . 0.0 110.07 174.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -64.74 116.22 6.06 Favored 'General case' 0 C--N 1.364 1.203 0 CA-C-O 121.714 0.769 . . . . 0.0 111.369 -179.262 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.2 m -146.82 143.55 28.68 Favored 'General case' 0 C--O 1.242 0.707 0 CA-C-N 114.874 -1.057 . . . . 0.0 108.158 176.307 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 88.6 mt -72.76 169.38 16.83 Favored 'General case' 0 C--O 1.246 0.89 0 CA-C-O 121.179 0.514 . . . . 0.0 110.806 177.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.9 mp -70.2 163.58 60.65 Favored Pre-proline 0 CA--C 1.557 1.233 0 C-N-CA 123.811 0.844 . . . . 0.0 110.484 178.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 98.5 Cg_exo -48.06 142.49 15.68 Favored 'Trans proline' 0 C--N 1.384 2.43 0 C-N-CA 122.477 2.118 . . . . 0.0 112.353 169.289 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.34 -35.24 50.53 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.522 0.729 . . . . 0.0 111.797 -177.195 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -147.43 148.66 31.51 Favored 'General case' 0 N--CA 1.47 0.537 0 N-CA-C 108.287 -1.005 . . . . 0.0 108.287 166.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -96.61 35.1 1.55 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.4 0.68 . . . . 0.0 109.882 177.536 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 24.7 tpt180 -95.0 92.23 6.76 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 123.823 0.849 . . . . 0.0 110.059 -173.496 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 6.5 mpt_? -80.51 90.63 5.69 Favored 'General case' 0 N--CA 1.479 0.998 0 CA-C-O 121.256 0.55 . . . . 0.0 109.798 -179.387 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -117.64 157.58 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.158 0.983 . . . . 0.0 109.407 175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.9 m-20 -48.41 154.65 0.6 Allowed 'General case' 0 N--CA 1.488 1.474 0 C-N-CA 125.263 1.425 . . . . 0.0 112.813 -179.553 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.6 m -54.59 -30.6 54.99 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.767 0.827 . . . . 0.0 111.568 170.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.7 mm-40 -53.52 -41.15 66.07 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 123.898 0.879 . . . . 0.0 111.683 172.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.65 36.72 2.33 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.837 0.855 . . . . 0.0 110.847 178.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -51.44 -21.54 2.43 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 114.671 1.359 . . . . 0.0 114.671 -179.179 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.518 HD13 ' HD2' ' A' ' 53' ' ' LYS . 98.5 mt -123.25 -42.93 2.22 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 108.997 -0.742 . . . . 0.0 108.997 172.131 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.29 -157.66 52.59 Favored Glycine 0 CA--C 1.529 0.922 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.892 -175.753 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 59.9 Cg_endo -83.64 3.69 7.52 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.852 2.368 . . . . 0.0 112.315 173.941 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -99.76 -54.06 3.02 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 124.304 1.042 . . . . 0.0 110.239 -175.873 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 108.31 -11.34 36.63 Favored Glycine 0 C--N 1.346 1.095 0 CA-C-N 115.824 -0.625 . . . . 0.0 114.459 179.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 pptp? -146.69 111.7 5.38 Favored 'General case' 0 N--CA 1.484 1.237 0 CA-C-N 117.887 0.844 . . . . 0.0 110.772 175.64 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.8 m -147.06 167.08 5.91 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.297 0 C-N-CA 124.219 1.008 . . . . 0.0 109.908 -177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.452 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 58.9 mt -90.75 120.85 40.36 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 N-CA-C 109.455 -0.572 . . . . 0.0 109.455 172.544 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.413 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -79.77 110.17 15.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 124.897 1.279 . . . . 0.0 110.376 -177.749 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -82.93 137.43 34.21 Favored 'General case' 0 C--O 1.253 1.264 0 CA-C-N 115.218 -0.901 . . . . 0.0 108.673 167.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 45.8 t-80 -160.27 95.69 1.15 Allowed 'General case' 0 C--O 1.245 0.841 0 C-N-CA 124.248 1.019 . . . . 0.0 109.227 -177.954 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 11.6 m120 65.06 31.18 11.28 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 124.3 1.04 . . . . 0.0 111.667 172.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 97.5 -15.16 62.51 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-N 115.999 -0.546 . . . . 0.0 113.111 179.988 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -87.61 142.92 27.47 Favored 'General case' 0 N--CA 1.478 0.937 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 174.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.413 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.8 pt-20 -129.31 137.13 50.84 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 177.546 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.568 ' HB3' ' HG3' ' A' ' 63' ' ' LYS . 0.8 OUTLIER -152.41 124.8 8.21 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.487 0.715 . . . . 0.0 110.997 179.506 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.452 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 2.8 tm? -70.82 122.9 20.75 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.524 1.13 . . . . 0.0 109.912 -175.086 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.483 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.2 tp -113.27 127.2 56.08 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.949 -1.13 . . . . 0.0 107.949 168.512 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 17.9 ptm180 -128.48 135.62 49.69 Favored 'General case' 0 C--N 1.323 -0.585 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.832 178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.518 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -75.95 99.36 4.51 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 107.921 -1.14 . . . . 0.0 107.921 166.627 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 29.3 p -65.17 138.73 58.45 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 108.599 -0.889 . . . . 0.0 108.599 178.269 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 -69.39 -5.7 25.25 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 123.889 0.743 . . . . 0.0 111.57 179.82 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -65.22 -14.63 61.11 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.065 0.946 . . . . 0.0 111.492 165.742 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 95.4 33.29 6.57 Favored Glycine 0 C--N 1.352 1.452 0 C-N-CA 124.061 0.839 . . . . 0.0 112.024 -179.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 54.1 mtmt -137.9 -175.21 4.01 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 122.96 0.504 . . . . 0.0 110.703 -173.534 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.483 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.1 mt -112.26 159.07 18.98 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.716 1.206 . . . . 0.0 109.774 171.829 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.7 tp -147.11 105.92 3.84 Favored 'General case' 0 N--CA 1.476 0.855 0 N-CA-C 108.95 -0.759 . . . . 0.0 108.95 176.177 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.469 HD21 ' HD2' ' A' ' 49' ' ' TYR . 2.4 tm? -99.6 101.21 12.35 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 107.966 -1.124 . . . . 0.0 107.966 179.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 61.0 p -120.11 132.68 55.51 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 124.055 0.942 . . . . 0.0 110.031 -179.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.568 ' HG3' ' HB3' ' A' ' 49' ' ' TYR . 0.6 OUTLIER . . . . . 0 C--O 1.253 1.284 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 171.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 64.5 mtt . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 109.357 -0.608 . . . . 0.0 109.357 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.1 m -104.18 113.81 27.62 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.41 0.684 . . . . 0.0 109.807 179.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 39.8 ptt180 -75.65 117.48 17.46 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 123.048 0.539 . . . . 0.0 110.024 178.475 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.0 ttt -145.87 152.36 39.35 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.929 0.892 . . . . 0.0 108.901 -176.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 m-20 67.21 102.52 0.05 OUTLIER 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 124.622 1.169 . . . . 0.0 110.747 -175.054 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 2.1 m-20 -70.22 135.82 49.39 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.366 0.666 . . . . 0.0 110.228 177.703 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 5.7 m -75.09 147.66 40.4 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.427 0.691 . . . . 0.0 109.817 176.45 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -69.9 156.04 39.67 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 123.482 0.713 . . . . 0.0 111.266 -179.852 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 47.0 mt -60.26 146.53 83.6 Favored Pre-proline 0 CA--C 1.56 1.347 0 C-N-CA 124.209 1.003 . . . . 0.0 111.639 -179.721 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -77.77 167.83 23.31 Favored 'Trans proline' 0 C--N 1.379 2.155 0 C-N-CA 122.541 2.161 . . . . 0.0 112.767 179.962 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 58.3 m170 -93.38 143.44 26.68 Favored Pre-proline 0 N--CA 1.478 0.965 0 CA-C-N 115.829 -0.623 . . . . 0.0 109.886 -178.429 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_exo -57.49 146.22 84.74 Favored 'Trans proline' 0 C--N 1.379 2.135 0 C-N-CA 123.229 2.62 . . . . 0.0 113.735 177.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.403 ' HG3' ' HG3' ' A' ' 14' ' ' GLU . 17.4 ptpt -66.66 -31.66 72.48 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.778 0.831 . . . . 0.0 110.484 175.105 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . 0.403 ' HG3' ' HG3' ' A' ' 13' ' ' LYS . 43.7 mt-10 -122.84 97.4 5.43 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.261 1.024 . . . . 0.0 108.29 175.003 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 41.7 mt -85.23 66.95 0.52 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 176.39 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 30.5 t70 58.81 112.3 0.01 OUTLIER 'General case' 0 CA--C 1.558 1.287 0 C-N-CA 125.408 1.483 . . . . 0.0 113.06 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 6.8 p30 -142.93 126.26 16.61 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 122.824 0.449 . . . . 0.0 110.844 176.714 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -101.38 77.47 1.78 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 108.784 -0.821 . . . . 0.0 108.784 173.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.0 m -73.62 106.26 5.31 Favored 'General case' 0 CA--C 1.549 0.938 0 CA-C-N 115.676 -0.693 . . . . 0.0 110.151 -179.803 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -75.95 179.4 5.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.704 0.802 . . . . 0.0 112.107 179.488 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp -69.86 141.9 90.28 Favored Pre-proline 0 CA--C 1.556 1.186 0 C-N-CA 124.434 1.093 . . . . 0.0 110.797 -177.305 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 95.4 Cg_endo -76.6 160.12 35.06 Favored 'Trans proline' 0 C--N 1.379 2.179 0 C-N-CA 122.749 2.3 . . . . 0.0 112.12 179.157 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.537 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -67.72 -54.03 22.69 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 122.847 0.459 . . . . 0.0 110.944 -177.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -170.67 141.87 1.92 Allowed 'General case' 0 N--CA 1.475 0.788 0 O-C-N 123.804 0.69 . . . . 0.0 110.349 178.73 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.9 mt-10 -94.34 40.33 1.09 Allowed 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.343 0.657 . . . . 0.0 110.38 174.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.463 ' HG3' HG13 ' A' ' 28' ' ' VAL . 3.0 tpm_? -91.15 90.69 7.92 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 124.067 0.947 . . . . 0.0 109.427 -179.395 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 4.6 mpt_? -80.66 91.36 5.84 Favored 'General case' 0 N--CA 1.476 0.871 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 -179.646 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.463 HG13 ' HG3' ' A' ' 26' ' ' ARG . 22.8 m -107.6 162.87 5.71 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.1 0 C-N-CA 124.046 0.938 . . . . 0.0 109.172 172.7 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 49.9 m-80 -66.13 164.03 16.4 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 122.859 0.463 . . . . 0.0 111.724 176.607 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.492 ' HB2' ' HB2' ' A' ' 44' ' ' HIS . 41.7 t -57.72 -28.7 64.11 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 124.388 1.075 . . . . 0.0 112.924 177.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -59.34 -32.65 70.29 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.052 0.541 . . . . 0.0 110.674 176.761 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.34 40.36 1.78 Allowed 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.119 0.968 . . . . 0.0 110.117 177.239 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.512 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.5 pt? -46.54 -21.45 0.18 Allowed 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 115.199 1.555 . . . . 0.0 115.199 -179.43 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.534 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -122.43 -33.0 3.52 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 122.923 0.489 . . . . 0.0 110.651 174.795 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.51 -152.56 52.36 Favored Glycine 0 CA--C 1.534 1.244 0 CA-C-O 119.296 -0.724 . . . . 0.0 112.445 -173.042 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -80.17 -13.69 12.44 Favored 'Trans proline' 0 C--N 1.371 1.729 0 C-N-CA 122.667 2.245 . . . . 0.0 112.504 171.309 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 -90.22 -43.0 10.7 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.882 0.873 . . . . 0.0 111.506 -170.137 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.474 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 94.58 -16.17 61.74 Favored Glycine 0 CA--C 1.529 0.921 0 CA-C-N 115.187 -0.915 . . . . 0.0 113.065 -171.913 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.537 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 6.5 ptpp? -130.36 93.28 3.43 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.736 0.814 . . . . 0.0 110.383 -177.387 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.8 m -141.66 164.99 18.75 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.802 0.841 . . . . 0.0 110.515 -177.214 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 58.0 mt -90.17 120.64 39.34 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.707 0 C-N-CA 123.351 0.66 . . . . 0.0 109.243 173.093 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.512 HG13 ' HA ' ' A' ' 33' ' ' LEU . 1.4 mp -78.76 132.01 33.17 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.453 0 C-N-CA 125.032 1.333 . . . . 0.0 109.156 176.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 21.3 t70 -114.17 118.67 34.66 Favored 'General case' 0 C--O 1.243 0.74 0 N-CA-C 108.3 -1.0 . . . . 0.0 108.3 172.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . 0.492 ' HB2' ' HB2' ' A' ' 30' ' ' SER . 6.1 t-80 -153.43 130.28 10.92 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 172.738 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 67.7 14.9 9.62 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.726 1.21 . . . . 0.0 110.735 -171.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 78.63 5.89 88.25 Favored Glycine 0 C--N 1.354 1.554 0 CA-C-N 116.414 -0.357 . . . . 0.0 113.064 -172.454 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 64.2 mt-30 -94.51 154.69 17.29 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.827 0.851 . . . . 0.0 109.753 -179.353 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.424 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -123.36 131.59 53.7 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.25 0.62 . . . . 0.0 111.008 -171.876 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.417 ' HB2' HD21 ' A' ' 61' ' ' LEU . 0.0 OUTLIER -144.98 120.89 10.64 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 176.367 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.405 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -80.73 107.19 13.33 Favored 'General case' 0 N--CA 1.481 1.08 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -177.768 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.461 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.1 tp -103.09 123.62 47.0 Favored 'General case' 0 C--O 1.246 0.891 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 175.107 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.452 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 7.9 ptm180 -128.92 133.47 47.88 Favored 'General case' 0 C--O 1.239 0.526 0 CA-C-N 115.59 -0.732 . . . . 0.0 110.293 -176.265 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.534 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -79.02 105.81 10.62 Favored 'General case' 0 C--O 1.238 0.482 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 172.379 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 27.0 p -70.5 143.64 51.63 Favored 'General case' 0 C--O 1.247 0.947 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.183 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -73.62 -3.34 27.41 Favored 'General case' 0 N--CA 1.485 1.318 0 C-N-CA 123.867 0.867 . . . . 0.0 112.451 -174.208 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -77.83 -7.58 56.85 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.905 0.882 . . . . 0.0 110.912 167.261 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 93.29 37.19 5.69 Favored Glycine 0 C--N 1.35 1.32 0 CA-C-N 115.626 -0.716 . . . . 0.0 112.595 177.175 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 48.6 mtmt -129.5 166.69 19.14 Favored 'General case' 0 N--CA 1.494 1.773 0 CA-C-O 120.987 0.422 . . . . 0.0 111.576 -176.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.461 ' HB3' HD11 ' A' ' 51' ' ' LEU . 56.3 mt -104.7 127.24 52.4 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.137 0.975 . . . . 0.0 108.907 172.15 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.0 tp -121.0 103.17 8.83 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 -177.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.417 HD21 ' HB2' ' A' ' 49' ' ' TYR . 2.4 tm? -88.3 111.84 22.15 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 107.797 -1.186 . . . . 0.0 107.797 176.491 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 39.4 p -122.61 137.69 54.82 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.435 1.094 . . . . 0.0 108.959 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 16.2 ptmt . . . . . 0 CA--C 1.554 1.099 0 C-N-CA 123.652 0.781 . . . . 0.0 109.015 -175.961 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ptt? . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 110.016 -0.364 . . . . 0.0 110.016 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 27.9 m -109.58 103.76 12.69 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 175.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 73.1 ttt-85 -128.03 -44.48 1.45 Allowed 'General case' 0 N--CA 1.471 0.577 0 C-N-CA 123.791 0.837 . . . . 0.0 110.29 -173.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 58.3 mtt 68.47 -165.65 0.19 Allowed 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 124.752 1.221 . . . . 0.0 109.659 -165.437 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -142.76 78.17 1.6 Allowed 'General case' 0 C--O 1.241 0.643 0 N-CA-C 108.168 -1.049 . . . . 0.0 108.168 175.229 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 22.4 m120 -134.51 77.22 1.68 Allowed 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 123.616 0.767 . . . . 0.0 109.854 -178.157 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 17.6 m -99.1 154.27 18.25 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-N 115.347 -0.842 . . . . 0.0 108.775 171.521 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -67.96 154.67 41.12 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.95 0.9 . . . . 0.0 110.625 -179.624 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.6 mt -61.13 119.41 45.3 Favored Pre-proline 0 CA--C 1.551 1.008 0 C-N-CA 123.553 0.741 . . . . 0.0 110.5 -177.29 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 41.7 Cg_exo -58.35 99.65 0.1 Allowed 'Trans proline' 0 C--N 1.382 2.319 0 C-N-CA 123.083 2.522 . . . . 0.0 112.882 -175.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 81.3 t60 -76.29 111.85 17.72 Favored Pre-proline 0 CA--C 1.542 0.655 0 N-CA-C 108.876 -0.787 . . . . 0.0 108.876 174.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -89.36 175.11 3.4 Favored 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 122.738 2.292 . . . . 0.0 112.621 -179.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 50.9 tptt -130.33 113.97 15.03 Favored 'General case' 0 C--O 1.237 0.439 0 N-CA-C 108.018 -1.104 . . . . 0.0 108.018 173.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.7 pt-20 -91.31 135.4 33.84 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 123.585 0.754 . . . . 0.0 109.532 175.851 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 62.0 mt -120.78 124.85 73.24 Favored 'Isoleucine or valine' 0 C--O 1.243 0.721 0 N-CA-C 108.206 -1.035 . . . . 0.0 108.206 176.885 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -106.38 148.68 27.8 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.548 0.739 . . . . 0.0 109.089 178.317 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -81.58 76.3 8.5 Favored 'General case' 0 N--CA 1.476 0.86 0 CA-C-O 121.733 0.777 . . . . 0.0 109.002 176.178 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -141.0 19.79 2.29 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.673 1.189 . . . . 0.0 109.356 176.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 35.6 m -53.33 135.33 39.07 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 124.761 1.225 . . . . 0.0 111.656 -176.18 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 76.0 mt -65.4 170.29 5.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.492 0.717 . . . . 0.0 111.836 -179.639 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.8 mp 69.64 164.89 0.13 Allowed Pre-proline 0 N--CA 1.49 1.545 0 C-N-CA 124.323 1.049 . . . . 0.0 110.622 -175.845 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.9 Cg_exo -54.0 140.11 69.9 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 121.809 1.673 . . . . 0.0 110.973 164.215 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -59.89 -28.03 67.22 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.023 0.529 . . . . 0.0 111.58 -178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.01 142.39 10.29 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.675 1.19 . . . . 0.0 108.061 167.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.471 ' HB2' ' NH1' ' A' ' 27' ' ' ARG . 11.0 pt-20 -90.59 31.89 1.01 Allowed 'General case' 0 N--CA 1.486 1.338 0 CA-C-O 121.313 0.577 . . . . 0.0 111.115 178.309 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 7.8 tpm_? -84.14 94.63 8.41 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 124.536 1.134 . . . . 0.0 109.646 -179.264 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.471 ' NH1' ' HB2' ' A' ' 25' ' ' GLU . 8.8 mpt_? -76.42 105.1 7.28 Favored 'General case' 0 N--CA 1.475 0.788 0 N-CA-C 109.264 -0.643 . . . . 0.0 109.264 175.586 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 17.7 m -121.86 159.66 24.34 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.586 0 C-N-CA 124.163 0.985 . . . . 0.0 108.906 170.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 53.0 t30 -64.51 155.17 33.73 Favored 'General case' 0 CA--C 1.551 0.992 0 C-N-CA 123.066 0.546 . . . . 0.0 109.661 170.369 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 18.7 t -55.33 -20.99 13.2 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.85 1.26 . . . . 0.0 113.714 -175.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 72.7 mt-30 -56.9 -38.79 73.31 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.382 0.673 . . . . 0.0 110.787 176.295 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.87 40.79 1.38 Allowed 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.131 0.972 . . . . 0.0 110.511 178.128 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -50.21 -18.44 0.59 Allowed 'General case' 0 N--CA 1.5 2.042 0 C-N-CA 124.792 1.237 . . . . 0.0 114.232 178.274 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 94.3 mt -125.24 -57.41 1.49 Allowed 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.737 0.815 . . . . 0.0 109.488 167.92 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.27 -154.24 52.41 Favored Glycine 0 CA--C 1.531 1.082 0 CA-C-N 114.831 -1.077 . . . . 0.0 112.259 -174.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_endo -75.9 -17.56 17.54 Favored 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 122.435 2.09 . . . . 0.0 111.701 169.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -69.99 -41.75 73.99 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 124.28 1.032 . . . . 0.0 110.462 -178.296 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.63 -5.81 49.98 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.283 -0.871 . . . . 0.0 113.795 -178.7 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.42 ' HA ' ' O ' ' A' ' 51' ' ' LEU . 0.0 OUTLIER -155.62 105.3 2.42 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 124.575 1.15 . . . . 0.0 108.745 -178.214 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 27.8 m -144.22 169.28 9.76 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 CA-C-O 121.139 0.495 . . . . 0.0 111.623 -173.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.443 ' HA ' ' O ' ' A' ' 49' ' ' TYR . 55.5 mt -90.07 110.87 22.47 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 CA-C-N 114.353 -1.294 . . . . 0.0 108.63 169.471 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.516 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.6 mp -75.8 132.28 33.43 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 C-N-CA 125.208 1.403 . . . . 0.0 109.25 178.997 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -105.35 107.68 18.8 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 106.971 -1.492 . . . . 0.0 106.971 164.672 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 26.8 t60 -123.9 96.6 5.01 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.257 -1.016 . . . . 0.0 108.257 -177.785 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.2 t30 60.61 42.44 13.95 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.59 1.156 . . . . 0.0 109.702 179.953 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.64 -18.7 28.48 Favored Glycine 0 C--N 1.353 1.525 0 CA-C-N 114.82 -1.082 . . . . 0.0 114.072 -178.813 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -83.96 118.55 24.09 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 123.802 0.841 . . . . 0.0 110.289 -176.096 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.516 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 0.0 OUTLIER -88.56 133.12 34.26 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 122.799 0.439 . . . . 0.0 110.849 -179.669 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.443 ' O ' ' HA ' ' A' ' 41' ' ' ILE . 5.5 m-85 -131.14 177.45 7.45 Favored 'General case' 0 N--CA 1.484 1.274 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 173.006 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -130.78 108.39 9.83 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 106.806 -1.553 . . . . 0.0 106.806 174.804 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.548 HD11 ' HB3' ' A' ' 59' ' ' LEU . 47.0 tp -104.41 124.19 48.78 Favored 'General case' 0 N--CA 1.483 1.218 0 N-CA-C 107.618 -1.253 . . . . 0.0 107.618 175.665 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.446 ' HE ' HG22 ' A' ' 54' ' ' THR . 13.0 ptt180 -125.96 136.94 53.59 Favored 'General case' 0 C--O 1.242 0.67 0 O-C-N 123.482 0.488 . . . . 0.0 110.642 -177.539 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 59.3 mtpt -79.15 99.12 6.83 Favored 'General case' 0 C--O 1.239 0.528 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 168.671 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.446 HG22 ' HE ' ' A' ' 52' ' ' ARG . 35.8 p -68.62 149.06 49.59 Favored 'General case' 0 C--O 1.25 1.097 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.748 178.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -72.33 -10.36 59.69 Favored 'General case' 0 N--CA 1.485 1.322 0 O-C-N 124.702 1.251 . . . . 0.0 113.218 -169.73 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -76.85 -14.34 59.91 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.472 0.709 . . . . 0.0 110.68 170.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 100.57 43.46 2.31 Favored Glycine 0 C--N 1.352 1.465 0 CA-C-N 115.64 -0.709 . . . . 0.0 111.967 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 46.4 mtmt -134.07 -179.49 5.59 Favored 'General case' 0 N--CA 1.497 1.904 0 CA-C-N 116.806 0.303 . . . . 0.0 111.402 -175.616 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.548 ' HB3' HD11 ' A' ' 51' ' ' LEU . 83.5 mt -124.14 129.41 50.79 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 124.844 1.258 . . . . 0.0 109.818 178.643 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 4.1 mp -123.56 105.1 9.47 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.674 0.79 . . . . 0.0 109.347 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.504 HD23 ' HB2' ' A' ' 51' ' ' LEU . 3.3 tm? -96.9 100.39 11.92 Favored 'General case' 0 N--CA 1.476 0.829 0 N-CA-C 107.2 -1.407 . . . . 0.0 107.2 178.788 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 49.3 p -130.71 135.53 47.9 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 124.224 1.01 . . . . 0.0 109.617 -176.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.404 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.025 0 C-N-CA 123.94 0.896 . . . . 0.0 109.183 -177.528 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.1 mpp? . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 46.2 m -72.75 147.31 45.7 Favored 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 123.033 0.533 . . . . 0.0 110.69 177.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 18.3 ttp180 -153.01 104.24 2.81 Favored 'General case' 0 C--O 1.238 0.484 0 N-CA-C 108.263 -1.014 . . . . 0.0 108.263 178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 57.3 ttm -76.5 90.48 3.29 Favored 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 177.606 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -64.97 111.06 2.68 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.63 0.772 . . . . 0.0 110.502 179.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.0 p-10 -84.92 160.45 20.11 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.302 0.641 . . . . 0.0 110.502 -179.472 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 87.9 m -76.8 135.43 38.94 Favored 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 123.29 0.636 . . . . 0.0 110.35 175.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -86.07 -177.88 6.4 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.456 0.702 . . . . 0.0 111.412 179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.77 149.18 70.48 Favored Pre-proline 0 N--CA 1.475 0.807 0 C-N-CA 123.139 0.576 . . . . 0.0 111.551 -176.653 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.6 Cg_exo -62.22 174.97 2.24 Favored 'Trans proline' 0 C--N 1.382 2.333 0 C-N-CA 123.665 2.91 . . . . 0.0 113.818 173.882 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 48.3 m80 -70.88 137.42 85.17 Favored Pre-proline 0 CA--C 1.552 1.038 0 C-N-CA 123.558 0.743 . . . . 0.0 110.247 179.051 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.9 Cg_endo -75.88 -169.21 0.64 Allowed 'Trans proline' 0 C--N 1.376 2.012 0 C-N-CA 122.698 2.265 . . . . 0.0 112.509 178.942 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.0 tttt -105.35 164.63 11.71 Favored 'General case' 0 N--CA 1.479 0.985 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 171.856 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.4 mm-40 -70.97 163.65 27.1 Favored 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.132 0.573 . . . . 0.0 110.02 168.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 60.3 mt -79.53 138.97 19.02 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.022 0 N-CA-C 109.993 -0.373 . . . . 0.0 109.993 179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -102.33 115.88 31.48 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.075 0.95 . . . . 0.0 109.141 178.532 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 21.0 m120 -124.57 110.01 13.91 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.222 0.609 . . . . 0.0 110.244 -178.482 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -118.75 29.54 7.67 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 124.176 0.99 . . . . 0.0 110.486 -175.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 20.5 m -63.0 119.05 8.7 Favored 'General case' 0 CA--C 1.547 0.827 0 C-N-CA 123.545 0.738 . . . . 0.0 111.124 -176.263 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 81.3 mt -72.44 164.01 27.08 Favored 'General case' 0 N--CA 1.471 0.625 0 C-N-CA 123.472 0.709 . . . . 0.0 110.72 178.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 9.0 mp -83.68 154.28 65.03 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.576 177.14 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -59.77 148.61 87.41 Favored 'Trans proline' 0 C--N 1.381 2.255 0 C-N-CA 122.247 1.965 . . . . 0.0 111.038 168.343 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.25 -37.08 69.27 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.508 0.723 . . . . 0.0 111.589 -177.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -151.43 161.65 42.33 Favored 'General case' 0 N--CA 1.468 0.465 0 CA-C-N 115.067 -0.97 . . . . 0.0 109.397 170.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -114.41 22.85 13.32 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.978 0.511 . . . . 0.0 109.987 171.155 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 17.6 tpp180 -77.18 88.61 3.64 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 -178.802 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 68.6 mtp180 -77.14 87.85 3.61 Favored 'General case' 0 C--O 1.242 0.703 0 CA-C-O 121.803 0.811 . . . . 0.0 110.11 -177.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -116.8 159.32 16.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 CA-C-N 114.46 -1.246 . . . . 0.0 109.347 178.331 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 43.6 m-80 -59.37 161.43 5.65 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.913 0.885 . . . . 0.0 112.248 -179.377 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 54.9 p -54.41 -30.33 51.92 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 124.068 0.947 . . . . 0.0 113.377 177.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 27.4 pt20 -62.65 -30.79 71.63 Favored 'General case' 0 N--CA 1.492 1.64 0 C-N-CA 122.643 0.377 . . . . 0.0 111.728 176.984 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.06 34.72 2.93 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 124.069 0.948 . . . . 0.0 110.661 176.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.421 ' HA ' HG13 ' A' ' 42' ' ' ILE . 2.6 pt? -49.48 -17.91 0.35 Allowed 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 115.434 1.642 . . . . 0.0 115.434 -179.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.529 HD13 ' HD2' ' A' ' 53' ' ' LYS . 97.0 mt -125.58 -41.92 1.98 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.118 0.567 . . . . 0.0 110.089 174.133 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.67 -162.89 44.4 Favored Glycine 0 CA--C 1.53 0.978 0 O-C-N 124.174 0.921 . . . . 0.0 112.699 -177.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 60.2 Cg_endo -70.5 -15.34 34.32 Favored 'Trans proline' 0 C--N 1.37 1.659 0 C-N-CA 122.549 2.166 . . . . 0.0 112.274 172.445 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.92 -40.66 46.41 Favored 'General case' 0 N--CA 1.473 0.701 0 C-N-CA 124.06 0.944 . . . . 0.0 111.165 -177.244 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.51 -6.63 83.09 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 116.047 -0.524 . . . . 0.0 112.347 -169.583 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.03 122.05 7.67 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.497 1.119 . . . . 0.0 109.501 -179.003 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 34.2 m -152.33 172.45 0.89 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.336 0 C-N-CA 123.812 0.845 . . . . 0.0 110.248 -178.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 36.3 mt -93.39 116.75 35.29 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.671 0 N-CA-C 108.532 -0.914 . . . . 0.0 108.532 167.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.477 HD11 ' HB3' ' A' ' 51' ' ' LEU . 1.4 mp -76.32 123.0 31.73 Favored 'Isoleucine or valine' 0 C--O 1.24 0.563 0 C-N-CA 124.596 1.158 . . . . 0.0 109.302 177.6 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.6 t70 -97.75 122.01 40.33 Favored 'General case' 0 C--O 1.246 0.886 0 N-CA-C 107.176 -1.416 . . . . 0.0 107.176 170.349 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.1 t-80 -157.94 117.18 3.22 Favored 'General case' 0 C--O 1.239 0.529 0 C-N-CA 123.314 0.646 . . . . 0.0 109.639 -179.166 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 13.5 m120 66.88 16.97 10.49 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.78 1.232 . . . . 0.0 111.92 179.578 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 93.37 -6.39 75.04 Favored Glycine 0 C--N 1.354 1.532 0 C-N-CA 122.989 0.328 . . . . 0.0 113.069 -176.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -90.46 156.98 17.81 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.751 0.82 . . . . 0.0 110.206 -179.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -129.23 126.02 38.2 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.742 0.817 . . . . 0.0 109.717 -177.122 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -143.7 136.79 27.66 Favored 'General case' 0 N--CA 1.494 1.726 0 C-N-CA 123.178 0.591 . . . . 0.0 109.655 177.244 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -84.63 123.98 30.95 Favored 'General case' 0 CA--C 1.545 0.767 0 C-N-CA 124.039 0.935 . . . . 0.0 109.301 -176.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.48 HD11 ' HB3' ' A' ' 59' ' ' LEU . 59.2 tp -119.5 136.8 54.17 Favored 'General case' 0 N--CA 1.483 1.175 0 N-CA-C 108.438 -0.949 . . . . 0.0 108.438 170.599 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.0 ptm180 -139.76 143.83 37.13 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 116.087 -0.506 . . . . 0.0 111.499 -178.709 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.529 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.4 mtpm? -83.02 98.99 9.56 Favored 'General case' 0 C--N 1.347 0.478 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 170.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.423 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -63.63 139.26 58.75 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.69 -0.856 . . . . 0.0 108.69 178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 30.1 pt20 -74.0 1.55 10.67 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 112.327 0.491 . . . . 0.0 112.327 -175.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.97 -18.79 63.37 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.548 0.739 . . . . 0.0 110.838 164.791 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 103.63 33.42 4.15 Favored Glycine 0 C--N 1.345 1.05 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.903 -179.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.423 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.6 mtpt -134.94 -178.07 4.92 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.7 0.8 . . . . 0.0 111.253 -173.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.48 ' HB3' HD11 ' A' ' 51' ' ' LEU . 69.8 mt -108.24 166.46 10.73 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 124.312 1.045 . . . . 0.0 109.99 169.141 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 16.4 tp -152.33 106.16 3.11 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 174.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -93.39 101.1 13.32 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 107.938 -1.134 . . . . 0.0 107.938 177.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -103.91 164.46 11.68 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 124.244 1.018 . . . . 0.0 108.991 172.457 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 74.9 mmtt . . . . . 0 C--O 1.255 1.347 0 CA-C-O 118.631 -0.699 . . . . 0.0 109.435 176.912 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 55.6 tpp . . . . . 0 N--CA 1.479 1.02 0 N-CA-C 109.747 -0.464 . . . . 0.0 109.747 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.8 m 62.38 16.24 8.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.295 1.038 . . . . 0.0 113.504 171.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.536 ' HA ' ' HB2' ' A' ' 6' ' ' ASN . 98.0 mtt180 -92.31 -11.7 34.43 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.236 0.614 . . . . 0.0 112.646 -175.555 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 15.5 tmm? -61.19 -37.32 82.54 Favored 'General case' 0 N--CA 1.485 1.305 0 CA-C-O 121.21 0.528 . . . . 0.0 109.756 174.437 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -134.04 94.68 3.29 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.739 -1.208 . . . . 0.0 107.739 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . 0.536 ' HB2' ' HA ' ' A' ' 3' ' ' ARG . 62.1 t30 -124.57 158.92 31.83 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.998 0.919 . . . . 0.0 108.809 -179.915 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 25.4 m -69.17 110.19 4.43 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.043 0.537 . . . . 0.0 111.323 -177.063 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.2 tt0 -77.24 159.62 29.5 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.706 0.802 . . . . 0.0 109.035 171.551 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.9 mt -59.98 110.65 2.99 Favored Pre-proline 0 N--CA 1.481 1.077 0 C-N-CA 123.276 0.63 . . . . 0.0 111.317 -179.264 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 66.7 Cg_endo -92.71 166.12 2.71 Favored 'Trans proline' 0 C--N 1.373 1.844 0 C-N-CA 122.853 2.369 . . . . 0.0 112.346 178.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 43.3 t-80 -146.88 111.89 4.16 Favored Pre-proline 0 CA--C 1.549 0.92 0 C-N-CA 123.864 0.865 . . . . 0.0 109.65 -179.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 2.7 Cg_exo -74.79 155.48 43.95 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 122.749 2.299 . . . . 0.0 111.343 174.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.8 mmmp? -106.26 -179.23 3.88 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.839 0.855 . . . . 0.0 110.836 -179.929 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -76.17 96.01 3.8 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.51 0.724 . . . . 0.0 109.618 -175.512 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 63.9 mt -68.7 108.15 1.51 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 124.055 0.942 . . . . 0.0 110.519 -176.645 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.7 t70 70.88 139.1 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 125.48 1.512 . . . . 0.0 112.72 173.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 41.7 m-80 -139.76 27.29 2.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.586 0.754 . . . . 0.0 110.706 -177.925 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 52.5 mt-10 -69.69 131.88 45.28 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 122.403 0.281 . . . . 0.0 111.577 -177.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.6 m -117.29 110.35 17.98 Favored 'General case' 0 N--CA 1.468 0.469 0 N-CA-C 108.623 -0.88 . . . . 0.0 108.623 173.516 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.7 mt -71.72 157.81 37.26 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-O 121.492 0.663 . . . . 0.0 110.961 -179.598 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 22.2 tp -84.81 121.78 74.5 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 114.373 -1.285 . . . . 0.0 110.242 -171.361 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 30.0 Cg_endo -62.56 119.28 6.3 Favored 'Trans proline' 0 C--N 1.379 2.156 0 C-N-CA 121.907 1.738 . . . . 0.0 110.751 172.561 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -52.69 -47.32 67.3 Favored 'General case' 0 C--N 1.362 1.142 0 C-N-CA 124.054 0.942 . . . . 0.0 112.093 -173.724 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -168.07 140.45 3.03 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 124.079 0.952 . . . . 0.0 109.448 179.093 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -95.36 24.91 4.71 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-O 121.619 0.723 . . . . 0.0 109.526 169.519 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 11.9 tpt180 -70.55 78.62 0.58 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 125.706 1.602 . . . . 0.0 110.143 -179.911 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 43.0 mtp180 -81.36 91.07 6.21 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.755 -176.258 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.8 m -122.76 154.13 27.87 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.084 0 C-N-CA 124.64 1.176 . . . . 0.0 109.565 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 51.2 t30 -60.33 155.52 17.72 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 123.558 0.743 . . . . 0.0 111.111 -179.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.443 ' HA ' HG23 ' A' ' 42' ' ' ILE . 48.3 p -51.44 -25.19 5.91 Favored 'General case' 0 CA--C 1.552 1.052 0 N-CA-C 115.206 1.558 . . . . 0.0 115.206 -176.031 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -66.66 -25.71 66.7 Favored 'General case' 0 N--CA 1.487 1.423 0 CA-C-O 121.422 0.63 . . . . 0.0 111.306 177.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.53 32.99 4.27 Favored 'General case' 0 CA--C 1.547 0.833 0 C-N-CA 124.709 1.204 . . . . 0.0 110.469 174.646 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -50.03 -18.32 0.53 Allowed 'General case' 0 N--CA 1.497 1.915 0 C-N-CA 124.593 1.157 . . . . 0.0 114.09 177.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.476 HD22 ' HG3' ' A' ' 53' ' ' LYS . 96.1 mt -126.4 -49.55 1.54 Allowed 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.64 0.776 . . . . 0.0 109.715 170.535 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 63.08 -152.96 46.03 Favored Glycine 0 CA--C 1.533 1.169 0 CA-C-N 115.563 -0.744 . . . . 0.0 113.589 179.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -74.43 -17.0 21.47 Favored 'Trans proline' 0 C--N 1.372 1.769 0 C-N-CA 122.682 2.255 . . . . 0.0 112.296 173.795 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -76.73 -38.78 53.66 Favored 'General case' 0 C--O 1.241 0.62 0 C-N-CA 124.192 0.997 . . . . 0.0 110.222 -175.936 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 77.59 -0.24 70.97 Favored Glycine 0 C--N 1.347 1.178 0 CA-C-N 115.202 -0.908 . . . . 0.0 112.953 -171.808 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.8 106.24 1.08 Allowed 'General case' 0 C--N 1.351 0.673 0 C-N-CA 124.427 1.091 . . . . 0.0 108.861 -174.811 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 9.9 m -138.73 169.66 17.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.963 0 C-N-CA 123.919 0.888 . . . . 0.0 110.034 -174.802 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 56.8 mt -91.76 109.02 20.72 Favored 'Isoleucine or valine' 0 C--O 1.243 0.756 0 N-CA-C 107.692 -1.225 . . . . 0.0 107.692 164.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.443 HG23 ' HA ' ' A' ' 30' ' ' SER . 54.4 mt -61.12 132.41 26.63 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.554 0 C-N-CA 124.033 0.933 . . . . 0.0 109.694 174.344 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 15.3 t70 -116.73 120.8 39.71 Favored 'General case' 0 C--O 1.238 0.461 0 N-CA-C 107.224 -1.398 . . . . 0.0 107.224 174.317 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.0 t60 -160.85 118.26 2.39 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 122.487 0.315 . . . . 0.0 111.269 -176.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.3 t30 55.65 51.1 13.1 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.178 1.391 . . . . 0.0 111.68 171.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.43 -18.89 12.29 Favored Glycine 0 CA--C 1.53 1.001 0 CA-C-N 115.15 -0.932 . . . . 0.0 114.317 177.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 42.7 mt-30 -105.39 144.08 32.67 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 123.52 0.728 . . . . 0.0 110.232 -173.674 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.422 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 12.0 pt-20 -134.43 138.42 44.78 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 122.922 0.489 . . . . 0.0 110.97 179.805 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -151.56 136.2 17.06 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.121 0.968 . . . . 0.0 110.236 -172.444 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -75.82 113.31 13.15 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.707 0.803 . . . . 0.0 109.957 -178.376 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.406 HD22 HD11 ' A' ' 42' ' ' ILE . 56.9 tp -104.29 138.8 40.21 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 108.624 -0.88 . . . . 0.0 108.624 169.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 38.3 ptt180 -141.29 146.66 37.06 Favored 'General case' 0 C--O 1.224 -0.276 0 CA-C-O 120.885 0.374 . . . . 0.0 111.058 176.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.476 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.4 mtpm? -78.64 107.64 11.46 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.531 -0.914 . . . . 0.0 108.531 167.294 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 2.7 p -67.33 130.07 41.89 Favored 'General case' 0 C--O 1.251 1.143 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 173.734 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -64.44 -20.07 65.93 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 123.852 0.72 . . . . 0.0 111.148 -179.53 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -59.44 -24.57 63.64 Favored 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 123.994 0.918 . . . . 0.0 111.187 171.694 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 113.03 43.03 0.88 Allowed Glycine 0 C--N 1.347 1.155 0 CA-C-N 115.543 -0.753 . . . . 0.0 112.492 173.244 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 55.5 mtmt -144.62 -174.39 4.31 Favored 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 123.102 0.561 . . . . 0.0 110.486 -178.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 91.8 mt -116.07 142.93 46.15 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 124.669 1.188 . . . . 0.0 108.739 169.706 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.1 tp -126.74 107.23 9.97 Favored 'General case' 0 C--O 1.241 0.61 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 176.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -90.89 125.92 35.9 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 173.327 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.9 p -141.39 167.74 21.43 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 125.154 1.382 . . . . 0.0 108.491 -176.991 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? . . . . . 0 C--O 1.25 1.09 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 172.136 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 68.5 mtm . . . . . 0 N--CA 1.47 0.567 0 N-CA-C 109.63 -0.508 . . . . 0.0 109.63 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 44.5 t -155.81 154.87 32.03 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 124.776 1.23 . . . . 0.0 108.674 177.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -93.75 -15.86 24.77 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 123.214 0.606 . . . . 0.0 109.609 176.954 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 1.9 mpt? 65.0 166.7 0.17 Allowed 'General case' 0 C--N 1.362 1.133 0 C-N-CA 125.307 1.443 . . . . 0.0 112.197 -178.46 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -128.85 151.23 49.85 Favored 'General case' 0 N--CA 1.477 0.913 0 CA-C-N 115.242 -0.89 . . . . 0.0 109.064 178.839 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 42.3 t-20 -160.53 146.14 14.87 Favored 'General case' 0 N--CA 1.478 0.963 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 -178.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.2 t -77.48 147.73 35.73 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 122.915 0.486 . . . . 0.0 110.545 178.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -100.56 170.41 8.39 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.454 0.702 . . . . 0.0 110.665 -177.472 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.4 mp -77.26 152.6 81.78 Favored Pre-proline 0 CA--C 1.552 1.054 0 C-N-CA 124.382 1.073 . . . . 0.0 110.242 -179.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 5.5 Cg_exo -77.11 174.27 13.09 Favored 'Trans proline' 0 C--N 1.378 2.124 0 C-N-CA 122.944 2.43 . . . . 0.0 113.267 -179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 65.2 m80 -67.29 142.41 96.73 Favored Pre-proline 0 CA--C 1.552 1.043 0 C-N-CA 123.889 0.876 . . . . 0.0 110.721 175.164 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 32.3 Cg_endo -62.32 138.06 69.28 Favored 'Trans proline' 0 C--N 1.378 2.112 0 C-N-CA 122.809 2.34 . . . . 0.0 111.995 176.865 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 95.3 mttt -81.23 150.17 28.72 Favored 'General case' 0 CA--C 1.55 0.978 0 C-N-CA 123.563 0.745 . . . . 0.0 111.139 -178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.91 144.27 47.41 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.308 0.643 . . . . 0.0 110.02 177.719 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 52.5 mt -99.22 -34.64 4.45 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.262 0 C-N-CA 122.874 0.47 . . . . 0.0 111.862 -172.578 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -54.98 136.47 47.62 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 113.414 0.894 . . . . 0.0 113.414 -173.592 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -151.34 27.74 0.66 Allowed 'General case' 0 CA--C 1.553 1.085 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 175.474 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 53.6 mt-10 -120.59 -30.4 4.52 Favored 'General case' 0 N--CA 1.479 1.023 0 CA-C-N 115.592 -0.731 . . . . 0.0 112.912 -166.644 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 75.7 p -79.45 66.74 5.0 Favored 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 121.961 0.886 . . . . 0.0 110.961 -179.155 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 72.2 mt -88.38 169.34 11.89 Favored 'General case' 0 C--O 1.244 0.764 0 C-N-CA 124.192 0.997 . . . . 0.0 109.459 -179.738 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.7 mp -65.67 142.14 98.11 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 122.865 0.466 . . . . 0.0 110.473 -179.332 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 75.5 Cg_exo -54.52 165.1 2.55 Favored 'Trans proline' 0 C--N 1.386 2.551 0 C-N-CA 123.428 2.752 . . . . 0.0 113.371 177.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -60.3 -34.54 73.93 Favored 'General case' 0 N--CA 1.481 1.115 0 CA-C-O 121.08 0.467 . . . . 0.0 111.031 175.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -161.59 173.54 14.61 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 115.107 -0.951 . . . . 0.0 109.879 176.768 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -142.34 38.57 1.55 Allowed 'General case' 0 CA--C 1.545 0.788 0 CA-C-O 122.012 0.91 . . . . 0.0 109.454 172.295 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 29.0 ttt180 -82.33 95.75 7.71 Favored 'General case' 0 CA--C 1.548 0.889 0 CA-C-N 114.784 -1.098 . . . . 0.0 109.939 173.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.78 95.01 3.94 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 177.762 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 10.9 m -131.36 158.2 43.28 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.03 0.932 . . . . 0.0 109.342 175.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 16.8 m-80 -62.09 158.58 16.34 Favored 'General case' 0 N--CA 1.48 1.056 0 O-C-N 124.134 0.897 . . . . 0.0 110.913 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 12.5 t -54.12 -22.39 10.97 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 124.713 1.205 . . . . 0.0 113.813 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 29.3 pt20 -58.39 -38.87 78.22 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 123.099 0.56 . . . . 0.0 110.915 175.538 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.03 36.37 2.37 Favored 'General case' 0 CA--C 1.545 0.775 0 C-N-CA 123.981 0.913 . . . . 0.0 110.596 177.987 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -52.03 -24.12 6.21 Favored 'General case' 0 N--CA 1.496 1.837 0 C-N-CA 124.553 1.141 . . . . 0.0 113.948 179.272 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 92.5 mt -130.33 -69.52 0.66 Allowed 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 123.107 0.563 . . . . 0.0 109.653 174.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.26 -161.6 50.15 Favored Glycine 0 CA--C 1.533 1.179 0 O-C-N 123.996 0.81 . . . . 0.0 112.071 -172.478 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.93 -11.83 31.39 Favored 'Trans proline' 0 C--N 1.37 1.706 0 C-N-CA 122.759 2.306 . . . . 0.0 112.448 170.119 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -67.39 -49.95 61.69 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 124.146 0.978 . . . . 0.0 109.662 174.818 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 76.47 3.58 78.15 Favored Glycine 0 C--N 1.351 1.408 0 CA-C-N 114.877 -1.056 . . . . 0.0 113.36 -177.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.5 ptpt -161.62 110.46 1.52 Allowed 'General case' 0 N--CA 1.473 0.719 0 C-N-CA 124.239 1.016 . . . . 0.0 108.29 -176.064 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.1 m -147.08 167.53 5.63 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.499 0 C-N-CA 123.013 0.525 . . . . 0.0 110.334 179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 42.1 mt -90.54 108.03 19.16 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.844 0 N-CA-C 108.399 -0.963 . . . . 0.0 108.399 166.811 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.528 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -68.32 135.25 28.81 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.459 0 C-N-CA 124.634 1.174 . . . . 0.0 109.41 176.776 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 22.5 t70 -115.69 127.06 54.88 Favored 'General case' 0 C--O 1.247 0.935 0 C-N-CA 124.521 1.128 . . . . 0.0 108.472 173.884 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -165.79 123.37 1.48 Allowed 'General case' 0 N--CA 1.474 0.756 0 C-N-CA 123.846 0.858 . . . . 0.0 109.688 173.848 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 3.2 t-20 67.3 26.77 8.46 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 124.588 1.155 . . . . 0.0 110.725 173.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 73.84 16.24 79.38 Favored Glycine 0 C--N 1.35 1.332 0 CA-C-N 115.545 -0.752 . . . . 0.0 113.121 -176.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -114.96 133.67 55.82 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 124.061 0.944 . . . . 0.0 108.833 -179.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.528 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.3 pt-20 -116.55 133.22 56.27 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.122 0.969 . . . . 0.0 110.541 -174.031 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -140.7 125.26 17.86 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 109.466 -0.568 . . . . 0.0 109.466 -179.443 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -79.64 106.05 11.39 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 177.017 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.417 ' HB3' HD11 ' A' ' 42' ' ' ILE . 59.9 tp -101.99 131.36 48.45 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 107.876 -1.157 . . . . 0.0 107.876 173.553 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.6 ptm180 -138.4 140.34 39.31 Favored 'General case' 0 C--O 1.238 0.46 0 O-C-N 123.836 0.71 . . . . 0.0 110.306 -175.844 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 62.3 mtpt -84.63 112.16 20.2 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 108.529 -0.915 . . . . 0.0 108.529 173.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.467 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 9.6 p -74.53 148.22 41.09 Favored 'General case' 0 C--O 1.252 1.211 0 N-CA-C 109.155 -0.683 . . . . 0.0 109.155 -179.079 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 9.8 pt20 -68.72 -8.61 44.34 Favored 'General case' 0 N--CA 1.484 1.248 0 O-C-N 124.17 0.919 . . . . 0.0 112.692 -176.731 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -75.9 -3.83 37.54 Favored 'General case' 0 CA--C 1.552 1.022 0 C-N-CA 123.591 0.757 . . . . 0.0 111.505 169.748 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 86.89 38.91 7.75 Favored Glycine 0 C--N 1.353 1.504 0 C-N-CA 123.355 0.503 . . . . 0.0 112.12 -179.862 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.467 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 22.8 mtpp -130.97 -178.48 4.84 Favored 'General case' 0 N--CA 1.492 1.648 0 C-N-CA 123.155 0.582 . . . . 0.0 110.675 -174.12 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 45.7 mt -111.3 156.24 21.83 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.46 1.104 . . . . 0.0 109.39 169.281 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.3 tp -144.76 101.57 3.67 Favored 'General case' 0 C--O 1.241 0.653 0 N-CA-C 108.274 -1.009 . . . . 0.0 108.274 176.098 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -84.56 114.73 22.18 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 107.059 -1.46 . . . . 0.0 107.059 174.462 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 46.7 p -126.45 154.79 43.22 Favored 'General case' 0 C--N 1.326 -0.456 0 C-N-CA 124.502 1.121 . . . . 0.0 108.565 177.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm . . . . . 0 C--O 1.25 1.079 0 N-CA-C 109.351 -0.611 . . . . 0.0 109.351 178.921 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.7 mtm . . . . . 0 N--CA 1.49 1.553 0 CA-C-O 120.408 0.147 . . . . 0.0 110.655 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.2 m -60.54 117.12 4.91 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 123.735 0.814 . . . . 0.0 110.897 179.959 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 5.6 mmp_? -95.25 145.93 24.71 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.466 0.706 . . . . 0.0 110.075 179.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 80.0 mtp -72.3 142.48 48.86 Favored 'General case' 0 C--O 1.242 0.659 0 O-C-N 124.01 0.819 . . . . 0.0 109.045 176.931 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 8.6 p-10 -63.56 156.03 27.75 Favored 'General case' 0 N--CA 1.48 1.072 0 O-C-N 123.643 0.589 . . . . 0.0 111.563 -175.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 21.4 m120 -63.47 153.7 34.64 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.163 0.585 . . . . 0.0 111.143 -178.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.9 m -75.38 74.18 2.46 Favored 'General case' 0 CA--C 1.554 1.114 0 C-N-CA 124.129 0.972 . . . . 0.0 111.792 -170.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 54.3 -171.32 0.05 Allowed 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 125.145 1.378 . . . . 0.0 112.91 178.698 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 pp -75.59 159.71 80.96 Favored Pre-proline 0 CA--C 1.552 1.036 0 N-CA-C 109.742 -0.466 . . . . 0.0 109.742 169.248 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 37.5 Cg_endo -64.95 130.11 25.01 Favored 'Trans proline' 0 C--N 1.37 1.7 0 C-N-CA 121.583 1.522 . . . . 0.0 110.793 174.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 31.5 p80 -68.24 143.06 95.43 Favored Pre-proline 0 CA--C 1.553 1.064 0 O-C-N 123.301 0.376 . . . . 0.0 110.124 177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -59.62 156.08 38.98 Favored 'Trans proline' 0 C--N 1.371 1.756 0 C-N-CA 122.753 2.302 . . . . 0.0 113.065 173.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -95.81 153.66 17.63 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 123.861 0.865 . . . . 0.0 109.564 178.28 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -61.42 113.26 2.56 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.447 0.699 . . . . 0.0 110.348 175.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 31.6 mt -91.24 103.81 14.85 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 176.364 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 7.0 p-10 -82.34 -170.29 2.85 Favored 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 170.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 38.8 t-20 -127.87 64.57 1.37 Allowed 'General case' 0 N--CA 1.478 0.957 0 N-CA-C 109.239 -0.652 . . . . 0.0 109.239 179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 56.77 84.77 0.09 Allowed 'General case' 0 CA--C 1.547 0.86 0 C-N-CA 125.134 1.373 . . . . 0.0 111.744 177.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 53.9 m -65.62 134.01 52.37 Favored 'General case' 0 CA--C 1.547 0.842 0 CA-C-N 115.727 -0.67 . . . . 0.0 111.136 -178.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.8 mt -79.24 162.13 25.89 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.533 0.733 . . . . 0.0 110.432 179.929 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 4.0 mp -109.1 145.49 31.86 Favored Pre-proline 0 N--CA 1.477 0.92 0 C-N-CA 123.843 0.857 . . . . 0.0 109.786 -177.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 57.0 Cg_endo -68.8 144.77 60.46 Favored 'Trans proline' 0 C--N 1.375 1.951 0 C-N-CA 122.414 2.076 . . . . 0.0 111.04 171.13 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -65.26 -47.99 74.78 Favored 'General case' 0 N--CA 1.473 0.724 0 O-C-N 123.46 0.475 . . . . 0.0 110.179 178.2 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -165.01 117.54 1.21 Allowed 'General case' 0 N--CA 1.469 0.511 0 O-C-N 123.848 0.717 . . . . 0.0 109.637 176.567 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.2 mt-10 -80.58 69.58 7.11 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.807 0.843 . . . . 0.0 109.196 173.597 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 26.9 tpt180 -125.67 88.73 2.91 Favored 'General case' 0 N--CA 1.471 0.623 0 C-N-CA 123.594 0.758 . . . . 0.0 109.114 -177.639 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 30.1 mtp85 -81.33 90.39 6.14 Favored 'General case' 0 C--O 1.243 0.75 0 CA-C-O 121.523 0.678 . . . . 0.0 110.375 -175.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.5 m -121.34 157.73 24.66 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.684 0 C-N-CA 124.758 1.223 . . . . 0.0 109.173 177.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -64.62 156.93 28.51 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.569 0.747 . . . . 0.0 110.148 176.522 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 9.8 t -56.41 -20.16 18.32 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 124.362 1.065 . . . . 0.0 113.787 -174.553 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 88.0 mm-40 -54.88 -40.85 70.18 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.771 0.828 . . . . 0.0 111.372 173.838 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.78 40.31 1.4 Allowed 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.491 1.116 . . . . 0.0 110.347 177.397 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -48.08 -18.53 0.2 Allowed 'General case' 0 N--CA 1.501 2.098 0 N-CA-C 115.72 1.748 . . . . 0.0 115.72 179.761 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.57 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 86.0 mt -117.25 -33.49 4.64 Favored 'General case' 0 N--CA 1.481 1.109 0 CA-C-N 118.538 0.608 . . . . 0.0 110.963 176.748 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.66 -145.61 45.68 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-O 118.939 -0.923 . . . . 0.0 112.465 -176.356 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -88.1 -13.41 3.75 Favored 'Trans proline' 0 C--N 1.369 1.64 0 C-N-CA 122.98 2.453 . . . . 0.0 112.92 172.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.5 m-20 -91.72 -29.15 16.98 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.591 0.757 . . . . 0.0 111.538 -173.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.57 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 86.11 0.67 86.99 Favored Glycine 0 CA--C 1.531 1.064 0 N-CA-C 111.553 -0.619 . . . . 0.0 111.553 -165.101 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 20.4 pttp -146.46 119.74 8.95 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.729 1.212 . . . . 0.0 109.197 -176.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.437 HG23 HD12 ' A' ' 42' ' ' ILE . 35.7 m -151.1 171.6 1.22 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.146 0 C-N-CA 124.137 0.975 . . . . 0.0 109.601 178.135 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 62.1 mt -91.35 106.54 17.71 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.787 0 N-CA-C 108.65 -0.87 . . . . 0.0 108.65 168.805 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.437 HD12 HG23 ' A' ' 40' ' ' VAL . 1.6 mp -68.48 137.08 25.15 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 C-N-CA 124.726 1.21 . . . . 0.0 109.926 176.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -112.4 126.57 55.43 Favored 'General case' 0 C--O 1.243 0.749 0 N-CA-C 108.042 -1.096 . . . . 0.0 108.042 169.882 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 22.8 t60 -164.47 140.68 6.11 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 108.724 -0.843 . . . . 0.0 108.724 173.731 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 26.1 m-80 66.55 14.76 9.88 Favored 'General case' 0 N--CA 1.495 1.78 0 C-N-CA 125.097 1.359 . . . . 0.0 111.442 -175.688 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 82.29 -5.38 72.84 Favored Glycine 0 C--N 1.352 1.459 0 C-N-CA 123.329 0.49 . . . . 0.0 112.8 -172.206 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.8 mt-30 -95.76 161.46 14.01 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.408 1.083 . . . . 0.0 109.782 -177.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -125.45 138.52 54.01 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.333 0.653 . . . . 0.0 110.14 -178.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.0 OUTLIER -146.4 140.21 26.16 Favored 'General case' 0 N--CA 1.486 1.336 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 179.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.5 tm? -86.04 122.72 30.46 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 178.694 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.473 HD11 ' HB3' ' A' ' 59' ' ' LEU . 56.4 tp -114.07 135.1 54.39 Favored 'General case' 0 N--CA 1.482 1.16 0 N-CA-C 107.624 -1.25 . . . . 0.0 107.624 167.222 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 11.6 ptm180 -138.86 137.8 36.88 Favored 'General case' 0 C--O 1.237 0.443 0 O-C-N 123.505 0.503 . . . . 0.0 111.094 176.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.562 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.8 mtpm? -79.01 102.38 8.31 Favored 'General case' 0 C--O 1.241 0.614 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 169.951 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.3 p -65.74 140.28 58.43 Favored 'General case' 0 C--O 1.247 0.972 0 N-CA-C 107.576 -1.268 . . . . 0.0 107.576 174.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 5.7 tp60 -75.44 -0.59 20.57 Favored 'General case' 0 N--CA 1.486 1.362 0 CA-C-O 121.126 0.489 . . . . 0.0 111.676 -175.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -74.93 -1.51 22.84 Favored 'General case' 0 CA--C 1.556 1.179 0 C-N-CA 123.895 0.878 . . . . 0.0 111.236 163.804 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.32 35.57 8.68 Favored Glycine 0 C--N 1.35 1.356 0 C-N-CA 124.018 0.818 . . . . 0.0 112.571 174.337 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.3 mtmt -133.96 173.85 11.12 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.667 0.387 . . . . 0.0 111.362 -174.413 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.473 ' HB3' HD11 ' A' ' 51' ' ' LEU . 79.6 mt -110.15 136.18 49.78 Favored 'General case' 0 N--CA 1.479 1.01 0 C-N-CA 124.939 1.295 . . . . 0.0 109.274 174.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.8 tp -126.33 98.7 5.55 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.501 -0.925 . . . . 0.0 108.501 -179.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -92.8 104.67 16.9 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 106.757 -1.571 . . . . 0.0 106.757 177.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 82.7 p -115.28 126.78 54.91 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.613 1.165 . . . . 0.0 108.88 175.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 34.2 mmtp . . . . . 0 CA--C 1.556 1.208 0 CA-C-O 118.489 -0.767 . . . . 0.0 110.909 -175.972 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.5 ptt? . . . . . 0 N--CA 1.482 1.155 0 N-CA-C 112.03 0.381 . . . . 0.0 112.03 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -91.56 98.57 11.74 Favored 'General case' 0 CA--C 1.549 0.931 0 C-N-CA 123.099 0.56 . . . . 0.0 109.87 -177.976 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 33.0 mmt180 -120.41 -77.66 0.58 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.982 0.913 . . . . 0.0 109.346 178.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 26.1 ttt -88.28 87.03 7.17 Favored 'General case' 0 C--O 1.245 0.831 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 173.539 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -80.86 77.88 7.7 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 108.401 -0.962 . . . . 0.0 108.401 173.864 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 4.1 p-10 -84.43 154.4 22.8 Favored 'General case' 0 C--O 1.24 0.576 0 CA-C-N 114.937 -1.029 . . . . 0.0 109.968 179.941 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 48.1 m -71.96 137.13 47.09 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 171.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.1 tp10 -59.82 145.08 46.79 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 123.787 0.835 . . . . 0.0 110.25 177.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -66.19 112.77 9.94 Favored Pre-proline 0 CA--C 1.545 0.775 0 C-N-CA 124.044 0.938 . . . . 0.0 109.643 178.812 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_exo -56.65 127.29 25.28 Favored 'Trans proline' 0 C--N 1.382 2.331 0 C-N-CA 122.926 2.417 . . . . 0.0 112.313 -177.844 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.2 m80 -61.29 142.55 93.51 Favored Pre-proline 0 CA--C 1.549 0.929 0 C-N-CA 123.417 0.687 . . . . 0.0 109.908 177.373 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 23.1 Cg_endo -58.97 111.9 1.04 Allowed 'Trans proline' 0 C--N 1.376 2.014 0 C-N-CA 122.665 2.243 . . . . 0.0 110.631 176.015 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -59.84 98.66 0.06 Allowed 'General case' 0 C--N 1.358 0.965 0 O-C-N 124.007 0.817 . . . . 0.0 110.622 -175.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 -87.8 135.64 33.3 Favored 'General case' 0 CA--C 1.538 0.516 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.959 179.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.3 mt -109.47 99.32 8.44 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.024 0 C-N-CA 123.618 0.767 . . . . 0.0 109.187 178.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -158.04 109.93 2.29 Favored 'General case' 0 N--CA 1.474 0.747 0 N-CA-C 109.382 -0.599 . . . . 0.0 109.382 178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 19.2 m120 -80.22 103.01 9.8 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.489 0.716 . . . . 0.0 110.568 -177.312 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -95.75 -3.74 45.29 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.749 0.82 . . . . 0.0 110.756 173.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 19.1 p -64.54 148.04 51.58 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.879 0.872 . . . . 0.0 110.99 174.363 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 49.3 mt -73.98 153.35 39.78 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.332 0.653 . . . . 0.0 111.264 -174.784 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 82.1 mt -86.81 141.72 33.86 Favored Pre-proline 0 N--CA 1.477 0.921 0 CA-C-N 115.533 -0.758 . . . . 0.0 110.715 -173.702 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -70.62 150.62 63.25 Favored 'Trans proline' 0 C--N 1.386 2.501 0 C-N-CA 122.69 2.26 . . . . 0.0 111.932 179.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.596 ' HB3' HD11 ' A' ' 50' ' ' LEU . . . -72.63 -42.32 64.56 Favored 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 122.756 0.423 . . . . 0.0 111.819 -176.648 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.09 163.97 28.34 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.208 0.603 . . . . 0.0 110.735 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.02 24.58 8.88 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.435 0.694 . . . . 0.0 110.13 172.276 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 35.1 ttt180 -81.28 93.71 6.59 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.919 0.487 . . . . 0.0 110.874 179.552 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.39 102.46 4.43 Favored 'General case' 0 N--CA 1.481 1.105 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 173.17 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 13.3 m -123.32 157.61 29.06 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.691 0 C-N-CA 124.705 1.202 . . . . 0.0 108.136 168.999 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.5 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 7.1 p30 -74.03 167.05 22.3 Favored 'General case' 0 N--CA 1.48 1.052 0 O-C-N 122.941 0.151 . . . . 0.0 110.675 -179.915 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 14.9 m -48.56 -30.94 5.81 Favored 'General case' 0 N--CA 1.482 1.168 0 N-CA-C 115.215 1.561 . . . . 0.0 115.215 -172.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 4.0 pt20 -62.81 -31.86 72.93 Favored 'General case' 0 N--CA 1.492 1.644 0 CA-C-N 118.503 0.592 . . . . 0.0 111.197 -178.104 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -103.86 30.07 5.39 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 124.391 1.077 . . . . 0.0 110.202 -178.923 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.6 pt? -48.94 -29.33 4.64 Favored 'General case' 0 N--CA 1.491 1.579 0 C-N-CA 124.523 1.129 . . . . 0.0 113.833 -179.784 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.534 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 93.3 mt -130.97 -69.92 0.62 Allowed 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 109.735 178.883 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.9 -151.66 52.12 Favored Glycine 0 CA--C 1.529 0.92 0 CA-C-N 115.274 -0.875 . . . . 0.0 111.932 -174.0 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo -73.27 -13.66 25.59 Favored 'Trans proline' 0 C--N 1.367 1.526 0 C-N-CA 122.523 2.148 . . . . 0.0 112.437 171.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -72.7 -60.49 2.21 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 124.167 0.987 . . . . 0.0 110.397 179.826 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.72 -17.33 45.73 Favored Glycine 0 C--N 1.34 0.778 0 CA-C-N 114.822 -1.081 . . . . 0.0 113.178 -175.937 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.3 ptpp? -136.45 99.38 4.07 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 123.654 0.782 . . . . 0.0 110.108 -179.876 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 35.4 m -146.69 165.3 7.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 124.02 0.928 . . . . 0.0 109.468 178.242 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.416 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 54.6 mt -90.19 118.54 35.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.848 0 C-N-CA 123.257 0.623 . . . . 0.0 109.666 176.028 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.4 mp -78.56 131.09 35.21 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 C-N-CA 124.972 1.309 . . . . 0.0 110.009 179.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.5 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 12.2 t70 -104.13 122.29 45.01 Favored 'General case' 0 C--O 1.247 0.953 0 C-N-CA 124.894 1.277 . . . . 0.0 107.781 171.35 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -156.98 110.53 2.61 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 123.31 0.644 . . . . 0.0 109.366 -175.46 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 19.0 m-80 61.65 28.25 17.46 Favored 'General case' 0 N--CA 1.492 1.658 0 C-N-CA 124.155 0.982 . . . . 0.0 111.375 -176.683 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 88.54 -9.35 76.15 Favored Glycine 0 C--N 1.347 1.14 0 CA-C-N 115.862 -0.608 . . . . 0.0 113.464 -178.599 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 44.2 mt-30 -81.18 138.38 35.85 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.445 0.698 . . . . 0.0 109.972 -177.217 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -111.45 124.75 52.91 Favored 'General case' 0 C--O 1.242 0.708 0 C-N-CA 123.879 0.871 . . . . 0.0 108.69 177.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.479 ' HD2' HD21 ' A' ' 61' ' ' LEU . 8.7 p90 -152.6 125.07 8.23 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 122.81 0.444 . . . . 0.0 112.054 177.952 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.596 HD11 ' HB3' ' A' ' 23' ' ' ALA . 3.2 tm? -77.93 115.54 17.74 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.611 1.165 . . . . 0.0 109.455 -173.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.441 HD11 ' HB3' ' A' ' 59' ' ' LEU . 36.0 tp -104.56 131.17 52.28 Favored 'General case' 0 N--CA 1.479 0.977 0 N-CA-C 108.031 -1.1 . . . . 0.0 108.031 171.893 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.403 ' HD3' HD23 ' A' ' 60' ' ' LEU . 15.7 ptm180 -134.52 134.31 41.28 Favored 'General case' 0 CA--C 1.541 0.614 0 O-C-N 124.043 0.839 . . . . 0.0 110.688 -175.455 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.458 ' HG3' HD22 ' A' ' 34' ' ' LEU . 9.8 mtpm? -82.74 103.9 12.59 Favored 'General case' 0 N--CA 1.471 0.612 0 N-CA-C 108.748 -0.834 . . . . 0.0 108.748 175.481 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 32.2 p -64.93 144.01 57.57 Favored 'General case' 0 C--O 1.253 1.254 0 O-C-N 123.968 0.793 . . . . 0.0 109.362 177.9 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -68.87 -11.63 60.73 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 124.358 1.063 . . . . 0.0 112.146 -178.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -73.93 -0.87 17.47 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.933 0.893 . . . . 0.0 111.431 169.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 81.96 44.53 7.62 Favored Glycine 0 C--N 1.354 1.53 0 C-N-CA 123.585 0.612 . . . . 0.0 112.2 177.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 47.8 mtmt -139.39 174.97 9.97 Favored 'General case' 0 N--CA 1.498 1.941 0 C-N-CA 122.555 0.342 . . . . 0.0 110.748 -176.284 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.441 ' HB3' HD11 ' A' ' 51' ' ' LEU . 80.9 mt -109.14 135.27 50.55 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.351 1.061 . . . . 0.0 109.957 171.919 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.403 HD23 ' HD3' ' A' ' 52' ' ' ARG . 14.6 tp -125.0 106.34 9.88 Favored 'General case' 0 C--O 1.241 0.657 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . 0.479 HD21 ' HD2' ' A' ' 49' ' ' TYR . 1.4 tm? -89.13 100.95 13.62 Favored 'General case' 0 CA--C 1.544 0.717 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 179.65 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 67.3 p -108.91 159.76 16.54 Favored 'General case' 0 CA--C 1.541 0.596 0 C-N-CA 123.796 0.838 . . . . 0.0 109.969 175.327 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt . . . . . 0 C--O 1.252 1.191 0 N-CA-C 108.654 -0.869 . . . . 0.0 108.654 174.981 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.2 mmm . . . . . 0 N--CA 1.478 0.927 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.7 t -89.49 108.01 19.4 Favored 'General case' 0 N--CA 1.472 0.643 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 32.5 ptt180 -144.75 8.46 1.29 Allowed 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.497 0.719 . . . . 0.0 111.197 179.716 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -105.82 114.19 28.19 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.061 0.944 . . . . 0.0 109.307 177.637 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -100.72 -5.67 26.13 Favored 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 123.424 0.69 . . . . 0.0 110.738 174.67 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 7.7 p30 -78.92 149.71 32.31 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.297 0.639 . . . . 0.0 109.368 171.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 31.5 m -79.11 91.47 4.92 Favored 'General case' 0 C--O 1.24 0.591 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 -179.524 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 44.5 mt-10 -71.99 132.53 44.42 Favored 'General case' 0 N--CA 1.469 0.488 0 N-CA-C 108.834 -0.802 . . . . 0.0 108.834 173.281 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 45.5 mt -86.07 114.65 58.29 Favored Pre-proline 0 CA--C 1.552 1.05 0 C-N-CA 123.232 0.613 . . . . 0.0 109.749 -173.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_exo -55.19 123.79 14.68 Favored 'Trans proline' 0 C--N 1.385 2.476 0 C-N-CA 123.458 2.772 . . . . 0.0 113.362 179.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 44.8 p-80 -116.59 89.6 28.3 Favored Pre-proline 0 CA--C 1.56 1.353 0 C-N-CA 123.301 0.641 . . . . 0.0 110.27 -179.834 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.1 Cg_endo -86.68 130.35 3.19 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 122.742 2.294 . . . . 0.0 112.345 176.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -146.77 142.23 27.54 Favored 'General case' 0 C--O 1.239 0.534 0 C-N-CA 122.939 0.496 . . . . 0.0 110.494 -179.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -66.7 107.7 2.23 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 171.287 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 60.9 mt -72.22 83.17 0.36 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.753 0 C-N-CA 123.243 0.617 . . . . 0.0 109.762 -176.978 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -168.76 108.7 0.49 Allowed 'General case' 0 N--CA 1.468 0.449 0 C-N-CA 124.988 1.315 . . . . 0.0 107.509 179.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -113.69 34.76 4.39 Favored 'General case' 0 N--CA 1.476 0.841 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 -179.876 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 44.7 32.8 0.83 Allowed 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 125.956 1.702 . . . . 0.0 112.786 -178.673 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 32.6 m -64.44 128.53 36.18 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 124.116 0.966 . . . . 0.0 111.179 -173.475 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 95.9 mt -76.8 -173.84 2.81 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.967 0.907 . . . . 0.0 111.845 -177.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 6.6 mp -59.22 138.79 88.37 Favored Pre-proline 0 CA--C 1.556 1.175 0 CA-C-N 114.885 -1.052 . . . . 0.0 110.31 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.466 ' HB2' ' HG ' ' A' ' 50' ' ' LEU . 1.6 Cg_endo -40.72 -55.36 2.01 Favored 'Trans proline' 0 C--N 1.391 2.766 0 C-N-CA 124.654 3.569 . . . . 0.0 113.09 -177.311 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . 175.75 -60.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 105.337 -2.097 . . . . 0.0 105.337 173.788 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -153.2 143.25 22.24 Favored 'General case' 0 C--O 1.238 0.45 0 CA-C-N 114.208 -1.36 . . . . 0.0 109.262 172.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 37.9 mt-10 -86.3 30.96 0.67 Allowed 'General case' 0 N--CA 1.487 1.423 0 C-N-CA 123.467 0.707 . . . . 0.0 111.571 178.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.461 ' HG3' HG13 ' A' ' 28' ' ' VAL . 7.8 tpp180 -87.96 92.87 9.29 Favored 'General case' 0 CA--C 1.543 0.696 0 C-N-CA 123.097 0.559 . . . . 0.0 109.616 177.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? -79.72 103.76 9.84 Favored 'General case' 0 C--N 1.35 0.63 0 N-CA-C 108.556 -0.905 . . . . 0.0 108.556 175.189 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.461 HG13 ' HG3' ' A' ' 26' ' ' ARG . 20.8 m -110.88 154.1 12.55 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.479 -0.934 . . . . 0.0 108.479 173.617 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 36.5 m-80 -52.44 150.13 5.13 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.481 0.712 . . . . 0.0 111.02 176.652 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.539 ' HA ' HG23 ' A' ' 42' ' ' ILE . 15.5 m -47.24 -35.17 7.32 Favored 'General case' 0 N--CA 1.493 1.694 0 N-CA-C 114.268 1.21 . . . . 0.0 114.268 -178.83 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 14.4 pt20 -58.09 -32.32 67.96 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.902 0.881 . . . . 0.0 112.202 178.356 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -104.66 31.23 4.86 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.284 1.034 . . . . 0.0 111.75 179.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -46.2 -22.83 0.27 Allowed 'General case' 0 N--CA 1.493 1.715 0 N-CA-C 114.988 1.477 . . . . 0.0 114.988 -178.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 96.1 mt -125.31 -68.9 0.81 Allowed 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.472 0.709 . . . . 0.0 109.923 174.614 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.78 -153.59 51.54 Favored Glycine 0 CA--C 1.535 1.341 0 CA-C-N 115.857 -0.61 . . . . 0.0 113.457 -178.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 69.7 Cg_endo -70.5 -16.65 34.46 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 122.983 2.456 . . . . 0.0 112.247 176.571 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -82.56 -56.64 3.75 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.834 0.854 . . . . 0.0 110.167 -178.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.9 -10.01 64.12 Favored Glycine 0 CA--C 1.528 0.901 0 CA-C-N 114.799 -1.091 . . . . 0.0 113.397 -175.538 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -136.41 73.53 1.46 Allowed 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.198 0.999 . . . . 0.0 110.708 -175.826 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 19.6 m -135.88 161.15 38.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 CA-C-N 114.887 -1.052 . . . . 0.0 110.008 -175.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.518 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 35.1 mt -86.83 121.79 38.11 Favored 'Isoleucine or valine' 0 C--O 1.244 0.797 0 CA-C-N 115.185 -0.916 . . . . 0.0 110.08 -178.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.541 HD11 HD22 ' A' ' 51' ' ' LEU . 48.8 mt -69.6 105.9 1.29 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.798 0.839 . . . . 0.0 109.39 173.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -87.16 121.52 29.73 Favored 'General case' 0 C--O 1.246 0.885 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 172.653 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 62.2 t60 -147.46 95.71 2.58 Favored 'General case' 0 C--O 1.241 0.658 0 O-C-N 123.869 0.731 . . . . 0.0 110.035 -175.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 23.6 m120 58.42 45.15 17.13 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.422 1.089 . . . . 0.0 112.034 175.859 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 85.84 -26.41 6.02 Favored Glycine 0 CA--C 1.529 0.919 0 CA-C-N 115.183 -0.917 . . . . 0.0 113.709 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 43.8 mt-30 -82.71 107.7 15.53 Favored 'General case' 0 C--O 1.238 0.5 0 N-CA-C 109.162 -0.681 . . . . 0.0 109.162 179.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -101.42 138.56 38.27 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.641 0.776 . . . . 0.0 109.675 178.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.605 ' HB3' ' HD3' ' A' ' 63' ' ' LYS . 0.1 OUTLIER -147.69 126.43 12.61 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.544 0.737 . . . . 0.0 109.035 177.636 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 2.9 tm? -71.71 126.14 28.94 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 123.115 0.566 . . . . 0.0 110.382 -174.458 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.586 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.0 tp -117.15 119.74 36.15 Favored 'General case' 0 N--CA 1.47 0.53 0 N-CA-C 108.725 -0.843 . . . . 0.0 108.725 172.093 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.561 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.9 ptm180 -126.6 136.27 52.31 Favored 'General case' 0 N--CA 1.474 0.763 0 CA-C-O 120.944 0.402 . . . . 0.0 110.616 179.767 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 58.1 mtpt -76.36 99.6 4.88 Favored 'General case' 0 C--O 1.241 0.633 0 N-CA-C 108.691 -0.855 . . . . 0.0 108.691 173.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 40.5 p -64.39 138.2 58.29 Favored 'General case' 0 C--O 1.25 1.088 0 N-CA-C 108.589 -0.893 . . . . 0.0 108.589 176.446 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -72.38 -7.11 47.95 Favored 'General case' 0 CA--C 1.552 1.033 0 O-C-N 124.764 1.29 . . . . 0.0 111.341 -177.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -70.76 -18.76 62.76 Favored 'General case' 0 CA--C 1.554 1.13 0 C-N-CA 123.888 0.875 . . . . 0.0 111.088 168.28 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 106.89 38.33 2.2 Favored Glycine 0 C--N 1.349 1.267 0 CA-C-N 115.627 -0.715 . . . . 0.0 112.984 175.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 51.4 mtmt -140.78 176.75 8.54 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-O 121.305 0.574 . . . . 0.0 111.428 -174.727 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.586 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.1 mt -108.15 136.58 47.59 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 124.516 1.126 . . . . 0.0 109.133 169.543 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 18.1 tp -119.34 103.69 9.71 Favored 'General case' 0 N--CA 1.473 0.694 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 178.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -91.42 124.75 35.84 Favored 'General case' 0 N--CA 1.473 0.706 0 N-CA-C 107.424 -1.324 . . . . 0.0 107.424 175.338 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 35.6 p -136.72 120.54 17.43 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 124.1 0.96 . . . . 0.0 108.981 -174.385 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HD3' ' HB3' ' A' ' 49' ' ' TYR . 35.1 mmtp . . . . . 0 C--O 1.254 1.322 0 C-N-CA 124.021 0.928 . . . . 0.0 109.819 177.45 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.408 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.483 1.224 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 13.7 p -85.02 78.15 9.96 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 123.629 0.772 . . . . 0.0 111.087 -174.707 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -114.15 79.8 1.3 Allowed 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 170.058 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 16.6 ptp -104.96 97.8 7.61 Favored 'General case' 0 CA--C 1.544 0.749 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.957 -176.703 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 9.4 p-10 -87.37 100.33 12.65 Favored 'General case' 0 CA--C 1.552 1.03 0 CA-C-N 115.372 -0.831 . . . . 0.0 110.151 -176.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 60.3 t30 -64.22 149.0 48.82 Favored 'General case' 0 N--CA 1.482 1.169 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.444 177.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -154.29 154.81 34.03 Favored 'General case' 0 C--O 1.243 0.712 0 C-N-CA 123.388 0.675 . . . . 0.0 109.843 179.521 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -97.73 153.68 18.09 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 124.268 1.027 . . . . 0.0 109.269 -178.585 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.3 pt? -76.44 153.93 83.88 Favored Pre-proline 0 CA--C 1.55 0.98 0 C-N-CA 122.82 0.448 . . . . 0.0 111.444 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.3 Cg_exo -56.12 132.3 51.1 Favored 'Trans proline' 0 C--N 1.381 2.267 0 C-N-CA 122.926 2.417 . . . . 0.0 112.108 171.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 39.1 m80 -96.69 161.47 26.49 Favored Pre-proline 0 CA--C 1.549 0.93 0 C-N-CA 123.936 0.895 . . . . 0.0 110.459 -177.577 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 94.9 Cg_exo -48.93 146.8 11.27 Favored 'Trans proline' 0 C--N 1.381 2.281 0 C-N-CA 123.317 2.678 . . . . 0.0 113.837 174.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -73.22 160.32 32.1 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.408 0.683 . . . . 0.0 112.303 -175.12 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -80.48 141.04 35.59 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 115.646 -0.707 . . . . 0.0 110.357 177.106 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 54.9 mt -128.1 99.86 5.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 108.888 -0.782 . . . . 0.0 108.888 176.499 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -132.21 70.14 1.47 Allowed 'General case' 0 N--CA 1.483 1.214 0 N-CA-C 108.779 -0.823 . . . . 0.0 108.779 176.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 40.8 t30 -91.79 96.96 10.7 Favored 'General case' 0 N--CA 1.476 0.837 0 CA-C-N 115.325 -0.852 . . . . 0.0 110.216 -177.673 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -137.62 15.61 2.93 Favored 'General case' 0 N--CA 1.495 1.777 0 C-N-CA 124.162 0.985 . . . . 0.0 110.157 174.501 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 25.1 p -75.89 100.31 4.77 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.517 0.727 . . . . 0.0 110.936 -175.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 70.1 mt -91.74 161.97 14.66 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.775 0.83 . . . . 0.0 110.283 176.968 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 85.2 mt -106.47 139.98 20.86 Favored Pre-proline 0 N--CA 1.477 0.875 0 C-N-CA 123.597 0.759 . . . . 0.0 110.267 -176.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 31.5 Cg_exo -60.93 161.12 23.05 Favored 'Trans proline' 0 C--N 1.383 2.39 0 C-N-CA 123.071 2.514 . . . . 0.0 112.617 175.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.461 ' HB1' ' HB2' ' A' ' 39' ' ' LYS . . . -56.85 -56.91 15.5 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 123.752 0.821 . . . . 0.0 112.672 -172.975 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -166.01 114.67 0.95 Allowed 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.12 0.568 . . . . 0.0 110.76 179.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -75.17 100.23 4.22 Favored 'General case' 0 CA--C 1.553 1.073 0 CA-C-O 121.992 0.901 . . . . 0.0 109.442 175.043 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -150.61 91.22 1.71 Allowed 'General case' 0 N--CA 1.469 0.518 0 C-N-CA 124.452 1.101 . . . . 0.0 108.865 -174.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 8.1 mpt_? -76.74 86.78 3.36 Favored 'General case' 0 N--CA 1.476 0.861 0 CA-C-N 115.759 -0.655 . . . . 0.0 109.447 -176.297 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 20.8 m -101.33 167.58 2.15 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.747 0 C-N-CA 124.451 1.1 . . . . 0.0 108.048 172.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -55.01 149.22 12.19 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.589 0.756 . . . . 0.0 111.343 176.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 31.9 t -58.71 -26.12 63.59 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.33 0.652 . . . . 0.0 111.609 174.46 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 85.9 mm-40 -60.49 -35.72 76.61 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.757 0.823 . . . . 0.0 110.983 172.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -99.54 30.54 3.54 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.193 0.997 . . . . 0.0 110.972 176.753 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -47.03 -28.44 1.68 Allowed 'General case' 0 N--CA 1.502 2.154 0 C-N-CA 124.918 1.287 . . . . 0.0 114.324 -178.888 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.449 ' HB3' ' HA2' ' A' ' 38' ' ' GLY . 88.7 mt -121.37 -56.12 1.91 Allowed 'General case' 0 C--O 1.241 0.636 0 C-N-CA 123.499 0.72 . . . . 0.0 109.376 175.419 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 70.25 -151.75 50.23 Favored Glycine 0 CA--C 1.531 1.078 0 CA-C-N 115.233 -0.894 . . . . 0.0 112.333 -175.315 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.86 -13.13 14.51 Favored 'Trans proline' 0 C--N 1.372 1.806 0 C-N-CA 122.535 2.157 . . . . 0.0 112.496 172.681 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 3.9 m-20 -83.58 -43.44 15.67 Favored 'General case' 0 N--CA 1.477 0.921 0 C-N-CA 123.672 0.789 . . . . 0.0 110.488 -177.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.449 ' HA2' ' HB3' ' A' ' 34' ' ' LEU . . . 79.0 4.32 88.66 Favored Glycine 0 C--N 1.345 1.083 0 CA-C-N 115.018 -0.992 . . . . 0.0 113.449 -178.028 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.461 ' HB2' ' HB1' ' A' ' 23' ' ' ALA . 17.3 ptpt -151.59 75.23 1.16 Allowed 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 121.756 0.789 . . . . 0.0 110.387 -173.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.7 m -141.46 169.6 14.21 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.956 0 C-N-CA 123.269 0.628 . . . . 0.0 110.124 -175.331 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.415 HG21 ' HB2' ' A' ' 48' ' ' GLU . 23.0 mt -91.59 125.08 44.32 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 CA-C-O 121.499 0.666 . . . . 0.0 110.9 -178.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.597 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -62.96 134.8 28.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.633 0 C-N-CA 125.839 1.656 . . . . 0.0 109.464 168.57 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 17.3 t70 -114.72 115.52 27.21 Favored 'General case' 0 C--O 1.242 0.697 0 N-CA-C 106.664 -1.606 . . . . 0.0 106.664 163.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.4 t-80 -126.73 87.23 2.62 Favored 'General case' 0 C--O 1.235 0.314 0 N-CA-C 108.025 -1.102 . . . . 0.0 108.025 177.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 5.1 t30 66.66 22.43 10.44 Favored 'General case' 0 CA--C 1.564 1.499 0 C-N-CA 124.617 1.167 . . . . 0.0 110.766 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 100.57 -4.99 56.79 Favored Glycine 0 C--N 1.351 1.416 0 O-C-N 121.772 -0.58 . . . . 0.0 113.333 -175.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 32.0 mm-40 -81.55 108.08 14.83 Favored 'General case' 0 N--CA 1.48 1.07 0 N-CA-C 108.649 -0.871 . . . . 0.0 108.649 174.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.597 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 9.8 pt-20 -98.25 135.21 40.21 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 123.477 0.486 . . . . 0.0 111.303 -174.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 6.2 m-85 -145.71 125.9 13.82 Favored 'General case' 0 N--CA 1.506 2.326 0 C-N-CA 123.555 0.742 . . . . 0.0 110.021 175.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -78.91 103.18 8.68 Favored 'General case' 0 N--CA 1.482 1.146 0 CA-C-N 118.565 0.62 . . . . 0.0 109.55 176.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 55.0 tp -96.72 132.33 42.51 Favored 'General case' 0 C--O 1.246 0.878 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 173.063 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 17.1 ptm180 -138.7 137.75 37.09 Favored 'General case' 0 C--O 1.242 0.661 0 O-C-N 123.54 0.525 . . . . 0.0 111.214 -175.247 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 54.7 mtpt -81.47 99.23 8.64 Favored 'General case' 0 N--CA 1.469 0.522 0 N-CA-C 108.004 -1.11 . . . . 0.0 108.004 174.774 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.431 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 17.1 p -67.7 142.47 56.31 Favored 'General case' 0 C--O 1.252 1.212 0 O-C-N 123.899 0.749 . . . . 0.0 109.412 -177.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 15.2 mm100 -64.01 -16.35 61.43 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 124.877 1.361 . . . . 0.0 112.004 -179.986 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.08 -7.63 31.06 Favored 'General case' 0 CA--C 1.556 1.208 0 C-N-CA 124.174 0.99 . . . . 0.0 112.459 171.452 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.02 42.66 5.9 Favored Glycine 0 C--N 1.352 1.447 0 C-N-CA 123.687 0.661 . . . . 0.0 112.007 179.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.431 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.8 mtpt -140.98 177.84 7.78 Favored 'General case' 0 N--CA 1.494 1.763 0 C-N-CA 123.092 0.557 . . . . 0.0 110.479 -172.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 25.2 mt -114.24 143.61 44.57 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 124.646 1.178 . . . . 0.0 109.198 169.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.537 ' HG ' HG23 ' A' ' 62' ' ' THR . 17.9 tp -132.98 105.32 7.01 Favored 'General case' 0 CA--C 1.543 0.706 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 -177.692 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -89.61 102.11 14.79 Favored 'General case' 0 N--CA 1.473 0.687 0 N-CA-C 107.105 -1.443 . . . . 0.0 107.105 178.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . 0.537 HG23 ' HG ' ' A' ' 60' ' ' LEU . 25.6 p -129.14 123.13 31.34 Favored 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.9 0.88 . . . . 0.0 109.913 -175.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.469 ' HD3' ' O ' ' A' ' 48' ' ' GLU . 24.1 tptp . . . . . 0 CA--C 1.552 1.025 0 N-CA-C 107.492 -1.299 . . . . 0.0 107.492 168.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 ptp . . . . . 0 CA--C 1.548 0.875 0 N-CA-C 110.107 -0.331 . . . . 0.0 110.107 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 15.5 t -164.14 -64.71 0.04 OUTLIER 'General case' 0 CA--C 1.551 1.001 0 C-N-CA 123.851 0.86 . . . . 0.0 109.004 173.244 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 24.3 mmt180 -98.22 -71.67 0.68 Allowed 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.987 0.915 . . . . 0.0 109.88 178.41 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 3.9 mmt -137.92 164.7 28.35 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 124.661 1.184 . . . . 0.0 109.468 -174.921 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 26.8 t70 -78.35 135.85 37.56 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 174.312 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -80.75 94.45 6.4 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.17 0.588 . . . . 0.0 110.409 -174.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.8 t -161.54 152.64 18.36 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.33 0.652 . . . . 0.0 109.842 -179.57 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -135.96 152.83 51.37 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.308 1.043 . . . . 0.0 109.246 177.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 79.1 mt -71.62 124.37 90.83 Favored Pre-proline 0 CA--C 1.552 1.031 0 C-N-CA 122.944 0.497 . . . . 0.0 109.691 178.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 61.1 Cg_endo -68.72 145.41 63.17 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.632 2.221 . . . . 0.0 112.604 -175.247 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 76.4 m80 -75.56 119.9 79.19 Favored Pre-proline 0 CA--C 1.547 0.832 0 C-N-CA 123.46 0.704 . . . . 0.0 109.538 177.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -69.44 138.33 38.57 Favored 'Trans proline' 0 C--N 1.372 1.803 0 C-N-CA 122.617 2.211 . . . . 0.0 111.739 178.717 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 24.8 ttmm -67.63 120.08 13.44 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.133 0.573 . . . . 0.0 110.776 179.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 12.5 pt-20 -84.3 132.29 34.64 Favored 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 108.523 -0.917 . . . . 0.0 108.523 169.333 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 63.4 mt -79.81 120.47 31.23 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 N-CA-C 109.393 -0.595 . . . . 0.0 109.393 178.458 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -134.12 95.01 3.33 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 124.34 1.056 . . . . 0.0 108.793 175.401 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 9.4 p30 -76.56 -8.12 56.57 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-N 115.497 -0.774 . . . . 0.0 110.931 178.162 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 1.7 mp0 -65.49 132.84 49.92 Favored 'General case' 0 C--N 1.351 0.653 0 C-N-CA 124.841 1.256 . . . . 0.0 110.026 -179.432 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.8 t -140.41 160.96 38.83 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.645 0.778 . . . . 0.0 109.641 -178.428 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 58.7 mt -85.69 148.39 25.91 Favored 'General case' 0 N--CA 1.473 0.685 0 N-CA-C 109.254 -0.647 . . . . 0.0 109.254 177.821 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 7.1 mp -125.82 86.01 58.29 Favored Pre-proline 0 CA--C 1.548 0.902 0 C-N-CA 123.967 0.907 . . . . 0.0 109.135 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_exo -64.45 -69.47 0.03 OUTLIER 'Trans proline' 0 C--N 1.379 2.139 0 C-N-CA 122.18 1.92 . . . . 0.0 110.643 170.123 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.527 ' HB3' HD21 ' A' ' 50' ' ' LEU . . . 167.32 -58.48 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 126.53 1.932 . . . . 0.0 106.813 179.389 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -162.44 118.15 1.91 Allowed 'General case' 0 C--O 1.241 0.637 0 C-N-CA 124.72 1.208 . . . . 0.0 108.518 175.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -71.05 90.39 0.84 Allowed 'General case' 0 C--N 1.352 0.706 0 C-N-CA 123.149 0.58 . . . . 0.0 109.587 174.273 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 2.1 tpm_? -139.01 84.2 2.0 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 124.09 0.956 . . . . 0.0 108.883 -178.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 7.2 mpt_? -75.94 86.18 2.87 Favored 'General case' 0 N--CA 1.479 1.009 0 CA-C-O 121.341 0.591 . . . . 0.0 110.24 -177.664 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 16.4 m -109.93 149.11 13.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.517 0 C-N-CA 124.468 1.107 . . . . 0.0 108.216 173.918 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 25.9 p-10 -51.83 157.87 1.12 Allowed 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 124.591 1.156 . . . . 0.0 112.702 -177.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.2 t -54.05 -28.05 36.27 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.209 1.004 . . . . 0.0 113.301 179.491 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 46.5 mt-30 -62.12 -34.98 77.36 Favored 'General case' 0 N--CA 1.484 1.269 0 CA-C-O 120.999 0.428 . . . . 0.0 110.654 176.028 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -100.4 35.59 2.08 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 124.589 1.156 . . . . 0.0 110.695 176.709 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 pt? -47.71 -21.53 0.39 Allowed 'General case' 0 N--CA 1.501 2.106 0 N-CA-C 115.451 1.648 . . . . 0.0 115.451 -179.769 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 85.9 mt -130.49 -43.3 1.14 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.256 0.623 . . . . 0.0 109.917 172.419 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 67.63 -158.6 51.21 Favored Glycine 0 CA--C 1.53 0.991 0 CA-C-N 115.343 -0.844 . . . . 0.0 112.62 -175.667 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -77.95 -14.47 15.33 Favored 'Trans proline' 0 CA--C 1.553 1.447 0 C-N-CA 122.46 2.107 . . . . 0.0 112.21 169.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -79.2 -35.42 41.77 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 123.878 0.871 . . . . 0.0 111.077 -174.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.0 -11.13 63.35 Favored Glycine 0 C--N 1.352 1.453 0 N-CA-C 114.665 0.626 . . . . 0.0 114.665 171.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.406 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -149.58 85.9 1.45 Allowed 'General case' 0 N--CA 1.485 1.307 0 CA-C-N 118.054 0.927 . . . . 0.0 110.183 -179.727 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 33.5 m -131.58 171.32 18.16 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.08 0 C-N-CA 123.393 0.677 . . . . 0.0 110.462 -171.512 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.421 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 32.9 mt -99.91 123.22 52.59 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.863 0 C-N-CA 123.183 0.593 . . . . 0.0 109.805 176.868 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.515 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.4 mp -73.55 122.7 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.336 0 C-N-CA 124.896 1.279 . . . . 0.0 109.011 177.43 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.0 t70 -93.59 123.03 36.64 Favored 'General case' 0 C--O 1.246 0.918 0 N-CA-C 107.395 -1.335 . . . . 0.0 107.395 169.279 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 85.8 t60 -148.63 96.71 2.63 Favored 'General case' 0 C--O 1.238 0.495 0 C-N-CA 123.706 0.802 . . . . 0.0 109.959 -177.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.4 HD22 ' N ' ' A' ' 45' ' ' ASN . 0.8 OUTLIER 59.15 30.94 20.83 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.576 1.151 . . . . 0.0 112.15 172.074 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 101.11 -22.3 39.89 Favored Glycine 0 C--N 1.348 1.222 0 CA-C-O 119.698 -0.501 . . . . 0.0 113.397 179.426 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.2 mt-30 -83.6 153.53 24.26 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 175.256 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.515 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 11.8 pt-20 -133.92 135.3 43.5 Favored 'General case' 0 N--CA 1.468 0.453 0 O-C-N 123.166 0.291 . . . . 0.0 110.617 -179.302 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -135.52 113.9 11.56 Favored 'General case' 0 N--CA 1.486 1.335 0 N-CA-C 109.458 -0.571 . . . . 0.0 109.458 179.71 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.527 HD21 ' HB3' ' A' ' 23' ' ' ALA . 3.3 tm? -70.21 110.59 5.29 Favored 'General case' 0 CA--C 1.547 0.861 0 N-CA-C 109.21 -0.663 . . . . 0.0 109.21 175.305 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.403 HD11 ' HB3' ' A' ' 59' ' ' LEU . 52.4 tp -106.56 118.62 37.13 Favored 'General case' 0 C--O 1.249 1.041 0 N-CA-C 107.763 -1.199 . . . . 0.0 107.763 172.485 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.406 ' HA ' ' HA ' ' A' ' 39' ' ' LYS . 16.6 ptm180 -123.6 137.05 54.82 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 122.979 0.512 . . . . 0.0 110.76 -177.794 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -78.47 99.32 6.39 Favored 'General case' 0 CA--C 1.542 0.663 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 170.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.465 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 29.0 p -69.58 142.84 53.48 Favored 'General case' 0 C--O 1.251 1.174 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 -178.659 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 70.3 mt-30 -69.44 -10.3 57.39 Favored 'General case' 0 N--CA 1.484 1.265 0 C-N-CA 124.105 0.962 . . . . 0.0 111.602 177.832 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -62.61 -24.41 67.56 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 123.572 0.749 . . . . 0.0 110.948 167.08 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 104.94 37.53 2.71 Favored Glycine 0 C--N 1.35 1.307 0 C-N-CA 124.358 0.98 . . . . 0.0 111.733 -179.559 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.465 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 45.9 mtpt -135.02 176.04 9.03 Favored 'General case' 0 N--CA 1.489 1.505 0 CA-C-O 121.444 0.64 . . . . 0.0 111.524 -172.641 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.403 ' HB3' HD11 ' A' ' 51' ' ' LEU . 49.8 mt -109.58 141.71 41.69 Favored 'General case' 0 N--CA 1.473 0.721 0 CA-C-N 114.035 -1.438 . . . . 0.0 107.405 163.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 14.7 tp -131.5 103.08 6.21 Favored 'General case' 0 C--O 1.24 0.571 0 N-CA-C 108.641 -0.874 . . . . 0.0 108.641 -177.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -88.54 113.19 23.87 Favored 'General case' 0 N--CA 1.469 0.483 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 37.2 p -137.63 142.03 41.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 124.534 1.134 . . . . 0.0 108.884 -175.485 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.157 0 C-N-CA 122.972 0.509 . . . . 0.0 109.653 -178.534 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 62.7 mtm . . . . . 0 N--CA 1.479 0.99 0 N-CA-C 109.427 -0.583 . . . . 0.0 109.427 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 22.9 t 50.6 76.81 0.14 Allowed 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 125.248 1.419 . . . . 0.0 112.86 175.263 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 30.7 mmm180 -84.44 -57.44 3.15 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 122.886 0.474 . . . . 0.0 109.96 179.446 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 24.1 ttt 66.1 126.81 0.02 OUTLIER 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 125.11 1.364 . . . . 0.0 112.748 -178.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 30.4 t70 -79.12 132.53 36.6 Favored 'General case' 0 N--CA 1.467 0.391 0 N-CA-C 109.703 -0.48 . . . . 0.0 109.703 170.218 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 16.5 m120 -115.52 111.44 20.73 Favored 'General case' 0 C--O 1.24 0.564 0 C-N-CA 123.597 0.759 . . . . 0.0 109.285 177.883 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -68.2 146.76 53.08 Favored 'General case' 0 CA--C 1.549 0.941 0 N-CA-C 109.709 -0.478 . . . . 0.0 109.709 175.314 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -120.25 157.22 29.6 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 122.821 0.448 . . . . 0.0 111.916 -167.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -64.66 154.67 84.38 Favored Pre-proline 0 CA--C 1.553 1.065 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.54 172.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 14.4 Cg_endo -53.91 101.56 0.07 OUTLIER 'Trans proline' 0 C--N 1.384 2.44 0 C-N-CA 123.36 2.706 . . . . 0.0 112.507 178.488 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 41.3 p-80 -81.81 144.63 52.29 Favored Pre-proline 0 N--CA 1.473 0.712 0 C-N-CA 123.298 0.639 . . . . 0.0 110.515 -177.086 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 91.5 Cg_endo -80.23 164.86 21.69 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 122.205 1.937 . . . . 0.0 111.804 171.518 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 60.3 tttm -155.7 106.56 2.5 Favored 'General case' 0 C--O 1.24 0.604 0 C-N-CA 123.541 0.736 . . . . 0.0 109.256 177.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 66.31 100.87 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.865 0 C-N-CA 125.201 1.4 . . . . 0.0 111.182 179.777 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 61.9 mt -83.18 122.21 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 123.92 0.888 . . . . 0.0 111.298 -173.402 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 35.7 t70 73.91 153.06 0.14 Allowed 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 125.012 1.325 . . . . 0.0 113.472 167.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 16.9 m120 -96.5 23.58 6.7 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 124.143 0.977 . . . . 0.0 112.135 -175.981 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -57.13 135.79 56.38 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.459 0.704 . . . . 0.0 112.059 178.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 24.6 m -116.53 104.0 10.97 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.239 -1.023 . . . . 0.0 108.239 174.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 83.6 mt -76.15 157.7 32.5 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 122.878 0.471 . . . . 0.0 110.445 179.522 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 96.1 mt -76.59 151.32 82.73 Favored Pre-proline 0 CA--C 1.545 0.788 0 CA-C-N 115.105 -0.952 . . . . 0.0 111.076 -177.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 14.8 Cg_endo -56.84 156.15 24.63 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 123.007 2.471 . . . . 0.0 112.626 170.201 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -57.01 -21.63 32.22 Favored 'General case' 0 N--CA 1.492 1.645 0 C-N-CA 123.898 0.879 . . . . 0.0 112.999 -177.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -154.99 161.1 41.48 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 124.402 1.081 . . . . 0.0 108.933 171.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.433 ' O ' ' HD3' ' A' ' 27' ' ' ARG . 0.0 OUTLIER -111.07 29.59 7.65 Favored 'General case' 0 N--CA 1.483 1.19 0 CA-C-O 121.894 0.854 . . . . 0.0 109.238 168.886 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 32.0 ttt180 -82.25 86.23 6.7 Favored 'General case' 0 CA--C 1.544 0.732 0 C-N-CA 123.778 0.831 . . . . 0.0 109.947 178.832 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.433 ' HD3' ' O ' ' A' ' 25' ' ' GLU . 0.8 OUTLIER -77.15 87.5 3.61 Favored 'General case' 0 C--N 1.36 1.023 0 CA-C-O 121.091 0.472 . . . . 0.0 110.185 177.949 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 18.5 m -101.86 154.35 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.665 0 N-CA-C 108.368 -0.975 . . . . 0.0 108.368 173.501 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 24.5 m-80 -58.6 150.55 22.78 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.097 0.559 . . . . 0.0 109.764 174.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 67.9 p -51.04 -25.05 4.33 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 113.973 1.101 . . . . 0.0 113.973 -175.698 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 13.4 pt20 -56.29 -38.73 71.64 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.82 0.848 . . . . 0.0 111.506 177.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -102.37 36.29 2.19 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 123.969 0.908 . . . . 0.0 110.777 178.778 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -46.39 -26.26 0.8 Allowed 'General case' 0 N--CA 1.494 1.74 0 C-N-CA 125.558 1.543 . . . . 0.0 115.029 -177.207 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.463 ' HG ' ' HG ' ' A' ' 33' ' ' LEU . 97.5 mt -127.38 -54.34 1.36 Allowed 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 122.824 0.45 . . . . 0.0 110.089 176.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 69.78 -158.46 53.39 Favored Glycine 0 CA--C 1.528 0.854 0 CA-C-N 115.84 -0.618 . . . . 0.0 112.488 -175.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.6 Cg_endo -78.21 -7.55 16.16 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.372 2.048 . . . . 0.0 112.031 172.47 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -79.92 -48.35 13.57 Favored 'General case' 0 N--CA 1.467 0.42 0 C-N-CA 124.459 1.104 . . . . 0.0 110.467 179.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 87.22 -12.9 61.16 Favored Glycine 0 C--N 1.344 1.019 0 CA-C-N 115.472 -0.786 . . . . 0.0 113.898 -179.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.403 ' HA ' ' HA ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -142.9 89.46 2.12 Favored 'General case' 0 N--CA 1.475 0.794 0 CA-C-N 117.579 0.69 . . . . 0.0 110.761 -177.791 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 22.3 m -140.56 163.01 23.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.439 0 C-N-CA 123.213 0.605 . . . . 0.0 110.363 -175.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.527 ' HA ' ' HA ' ' A' ' 50' ' ' LEU . 25.7 mt -88.49 125.41 41.76 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 CA-C-O 120.92 0.39 . . . . 0.0 110.373 -178.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -81.15 119.57 31.04 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.182 0 C-N-CA 125.246 1.419 . . . . 0.0 109.329 178.152 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 34.4 t70 -103.19 115.4 30.5 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 108.178 -1.045 . . . . 0.0 108.178 174.059 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -161.99 142.07 10.15 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 124.158 0.983 . . . . 0.0 108.729 178.801 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . 0.472 ' HB2' HE21 ' A' ' 47' ' ' GLN . 17.6 m-80 70.18 12.61 7.69 Favored 'General case' 0 N--CA 1.496 1.87 0 C-N-CA 125.554 1.542 . . . . 0.0 111.611 -177.72 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 77.02 14.0 83.09 Favored Glycine 0 C--N 1.345 1.034 0 N-CA-C 112.254 -0.338 . . . . 0.0 112.254 -170.738 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . 0.472 HE21 ' HB2' ' A' ' 45' ' ' ASN . 40.6 mt-30 -111.15 158.05 19.35 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.348 1.059 . . . . 0.0 108.683 178.064 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 10.1 pt-20 -134.74 125.86 27.83 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 122.811 0.444 . . . . 0.0 110.435 -179.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 3.3 p90 -148.5 126.78 12.21 Favored 'General case' 0 CA--C 1.551 0.99 0 C-N-CA 124.193 0.997 . . . . 0.0 111.273 -174.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.527 ' HA ' ' HA ' ' A' ' 41' ' ' ILE . 3.3 tm? -75.29 122.74 24.17 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 124.855 1.262 . . . . 0.0 110.722 -172.602 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.499 HD11 ' HB3' ' A' ' 59' ' ' LEU . 54.9 tp -111.29 127.04 55.5 Favored 'General case' 0 C--O 1.245 0.866 0 N-CA-C 107.62 -1.252 . . . . 0.0 107.62 167.952 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.448 ' HD3' HD23 ' A' ' 60' ' ' LEU . 16.9 ptm180 -128.24 142.93 51.02 Favored 'General case' 0 C--O 1.238 0.462 0 O-C-N 123.71 0.631 . . . . 0.0 110.564 -178.342 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.42 ' HD2' HD13 ' A' ' 34' ' ' LEU . 27.5 mtpp -83.59 104.88 14.07 Favored 'General case' 0 C--O 1.236 0.361 0 CA-C-N 115.147 -0.933 . . . . 0.0 108.717 171.092 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 26.2 p -71.4 134.23 46.5 Favored 'General case' 0 C--O 1.243 0.711 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 172.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -72.98 -0.64 14.33 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.648 0.779 . . . . 0.0 111.964 -175.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -72.15 -14.21 61.76 Favored 'General case' 0 CA--C 1.55 0.948 0 C-N-CA 123.953 0.901 . . . . 0.0 110.715 166.891 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 101.82 35.15 4.11 Favored Glycine 0 C--N 1.348 1.201 0 CA-C-N 115.854 -0.612 . . . . 0.0 112.501 176.855 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 50.0 mtmt -139.42 173.52 11.46 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 123.006 0.523 . . . . 0.0 111.289 -174.376 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.499 ' HB3' HD11 ' A' ' 51' ' ' LEU . 59.7 mt -111.26 144.42 40.45 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.301 1.04 . . . . 0.0 109.242 174.725 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . 0.448 HD23 ' HD3' ' A' ' 52' ' ' ARG . 16.3 tp -132.47 113.83 13.58 Favored 'General case' 0 N--CA 1.475 0.814 0 N-CA-C 108.355 -0.98 . . . . 0.0 108.355 -177.263 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.76 124.52 35.95 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.327 -0.99 . . . . 0.0 108.327 177.485 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 80.9 p -142.39 -169.59 3.0 Favored 'General case' 0 CA--C 1.541 0.613 0 C-N-CA 126.155 1.782 . . . . 0.0 106.534 179.182 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.479 ' HA ' ' H ' ' A' ' 50' ' ' LEU . 0.0 OUTLIER . . . . . 0 C--O 1.259 1.576 0 O-C-N 121.548 -0.72 . . . . 0.0 110.577 175.588 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 110.219 -0.289 . . . . 0.0 110.219 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.7 m -68.3 -66.4 0.57 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.003 0.521 . . . . 0.0 110.723 -179.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 1.6 tmm_? 62.68 -80.56 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.412 0 C-N-CA 124.906 1.282 . . . . 0.0 109.435 -177.987 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 65.2 mtt -139.6 107.75 5.76 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 107.22 -1.4 . . . . 0.0 107.22 170.351 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -59.66 -57.04 14.67 Favored 'General case' 0 N--CA 1.48 1.053 0 C-N-CA 123.612 0.765 . . . . 0.0 111.986 -177.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 55.1 t30 66.09 136.31 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 125.574 1.549 . . . . 0.0 112.454 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.7 t -141.6 151.19 42.93 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 123.642 0.777 . . . . 0.0 109.477 176.522 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.1 mt-10 -108.89 139.55 43.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.817 0.847 . . . . 0.0 109.816 -178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.8 mp -81.26 129.02 68.37 Favored Pre-proline 0 CA--C 1.547 0.845 0 C-N-CA 123.211 0.604 . . . . 0.0 109.869 179.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 45.5 Cg_exo -58.64 150.31 70.72 Favored 'Trans proline' 0 C--N 1.379 2.16 0 C-N-CA 122.941 2.427 . . . . 0.0 112.918 177.115 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 50.0 p-80 -86.78 148.5 46.03 Favored Pre-proline 0 N--CA 1.474 0.773 0 C-N-CA 122.878 0.471 . . . . 0.0 110.882 -178.071 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -68.86 178.97 3.52 Favored 'Trans proline' 0 C--N 1.375 1.952 0 C-N-CA 122.797 2.332 . . . . 0.0 112.331 170.065 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 98.1 mttt -62.19 141.6 58.1 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 123.502 0.721 . . . . 0.0 111.811 -177.701 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -64.1 126.65 28.4 Favored 'General case' 0 CA--C 1.553 1.078 0 C-N-CA 123.525 0.73 . . . . 0.0 110.836 178.667 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 64.2 mt -114.53 109.06 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 C-N-CA 123.381 0.672 . . . . 0.0 109.424 -177.548 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 2.8 m-20 -82.75 147.96 28.13 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-N 115.491 -0.777 . . . . 0.0 109.251 171.473 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 3.9 m-20 -91.23 33.83 0.96 Allowed 'General case' 0 N--CA 1.487 1.402 0 C-N-CA 123.566 0.746 . . . . 0.0 111.146 178.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 63.81 98.99 0.04 OUTLIER 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 125.722 1.609 . . . . 0.0 112.249 175.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 8.9 t -70.79 125.33 26.52 Favored 'General case' 0 CA--C 1.548 0.876 0 CA-C-O 121.061 0.458 . . . . 0.0 109.967 174.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 73.6 mt -92.24 172.99 8.05 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 123.478 0.711 . . . . 0.0 109.818 178.204 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 79.4 mt -71.56 153.21 93.69 Favored Pre-proline 0 CA--C 1.554 1.12 0 C-N-CA 123.62 0.768 . . . . 0.0 111.572 -177.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 82.7 Cg_exo -52.02 150.21 19.14 Favored 'Trans proline' 0 C--N 1.386 2.503 0 C-N-CA 123.253 2.636 . . . . 0.0 112.961 172.499 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.513 ' HB1' ' HD3' ' A' ' 39' ' ' LYS . . . -57.15 -44.37 83.34 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.275 0.63 . . . . 0.0 111.587 -179.568 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . 0.488 ' HB3' ' O ' ' A' ' 39' ' ' LYS . . . -164.58 118.8 1.37 Allowed 'General case' 0 C--O 1.241 0.655 0 C-N-CA 123.748 0.819 . . . . 0.0 109.606 172.262 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 -77.83 85.52 4.1 Favored 'General case' 0 CA--C 1.549 0.939 0 CA-C-O 122.036 0.922 . . . . 0.0 109.789 177.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.401 ' HG3' HG13 ' A' ' 28' ' ' VAL . 19.7 tpp180 -137.47 90.08 2.48 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.719 -178.526 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 83.0 mtt180 -74.85 89.66 2.35 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.529 -179.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.401 HG13 ' HG3' ' A' ' 26' ' ' ARG . 23.5 m -112.61 161.11 11.72 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.759 0 C-N-CA 125.006 1.323 . . . . 0.0 109.214 172.699 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.439 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 58.5 t30 -69.66 160.62 31.25 Favored 'General case' 0 CA--C 1.558 1.256 0 C-N-CA 123.401 0.68 . . . . 0.0 109.972 175.351 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 20.5 m -50.04 -27.56 5.74 Favored 'General case' 0 N--CA 1.497 1.897 0 C-N-CA 124.45 1.1 . . . . 0.0 113.89 178.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -57.27 -34.59 68.81 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.59 0.756 . . . . 0.0 111.694 178.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -108.59 40.83 1.7 Allowed 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.106 0.962 . . . . 0.0 110.492 176.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -50.56 -20.25 1.12 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 114.701 1.371 . . . . 0.0 114.701 -178.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . . . . . . . . . 91.2 mt -132.21 -54.2 0.97 Allowed 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.301 0.64 . . . . 0.0 109.317 173.347 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 66.79 -144.46 45.28 Favored Glycine 0 CA--C 1.532 1.144 0 CA-C-N 115.201 -0.909 . . . . 0.0 112.974 177.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 79.2 Cg_endo -79.85 -12.48 13.43 Favored 'Trans proline' 0 C--N 1.376 2.016 0 C-N-CA 122.587 2.192 . . . . 0.0 112.35 177.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 13.8 m-20 -85.95 -42.9 13.65 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.847 0.859 . . . . 0.0 110.572 -174.992 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.69 3.07 86.8 Favored Glycine 0 C--N 1.347 1.165 0 CA-C-N 115.966 -0.561 . . . . 0.0 112.697 -173.774 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.513 ' HD3' ' HB1' ' A' ' 23' ' ' ALA . 8.4 ptpp? -160.58 109.82 1.7 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.501 -1.296 . . . . 0.0 107.501 -179.281 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 25.2 m -148.57 174.92 1.33 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.236 0 C-N-CA 123.701 0.8 . . . . 0.0 111.011 -176.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . 0.404 ' CG2' ' HB2' ' A' ' 48' ' ' GLU . 58.8 mt -98.63 108.95 23.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.203 0 C-N-CA 124.127 0.971 . . . . 0.0 109.306 172.24 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.496 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -71.72 135.39 28.01 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 C-N-CA 125.142 1.377 . . . . 0.0 110.427 176.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.439 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 15.8 t70 -103.71 120.77 41.6 Favored 'General case' 0 C--O 1.246 0.906 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 169.889 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 52.6 t60 -160.42 115.38 2.25 Favored 'General case' 0 CA--C 1.544 0.733 0 O-C-N 123.956 0.785 . . . . 0.0 110.004 -176.495 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 33.6 m120 61.88 28.31 17.28 Favored 'General case' 0 N--CA 1.488 1.467 0 C-N-CA 124.805 1.242 . . . . 0.0 111.838 -178.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 80.49 -7.69 56.78 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.374 -0.83 . . . . 0.0 113.564 -176.271 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -93.13 137.89 32.06 Favored 'General case' 0 C--O 1.24 0.601 0 C-N-CA 123.903 0.881 . . . . 0.0 108.646 -177.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.496 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 16.2 pt-20 -108.72 129.92 55.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 123.137 0.575 . . . . 0.0 109.933 -178.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 1.3 m-85 -127.07 125.54 41.48 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.975 0.51 . . . . 0.0 109.658 -179.61 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -76.95 100.71 5.68 Favored 'General case' 0 CA--C 1.554 1.103 0 N-CA-C 108.126 -1.064 . . . . 0.0 108.126 170.91 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 65.1 tp -98.75 124.86 43.87 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 107.546 -1.279 . . . . 0.0 107.546 172.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 16.1 ptm180 -131.24 140.17 49.79 Favored 'General case' 0 C--N 1.329 -0.323 0 C-N-CA 123.103 0.561 . . . . 0.0 110.261 -177.776 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . . . . . . . . . 57.1 mtpt -76.68 112.44 13.25 Favored 'General case' 0 C--O 1.24 0.592 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 166.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.475 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 10.4 p -70.32 146.39 50.57 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.09 -1.078 . . . . 0.0 108.09 179.166 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 19.9 mt-30 -67.63 -9.46 43.29 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 124.435 1.094 . . . . 0.0 111.679 -178.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -80.97 5.27 16.82 Favored 'General case' 0 CA--C 1.558 1.286 0 C-N-CA 124.218 1.007 . . . . 0.0 111.448 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 79.53 40.46 15.36 Favored Glycine 0 C--N 1.353 1.492 0 C-N-CA 123.431 0.539 . . . . 0.0 112.702 177.457 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.475 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 49.0 mtpt -133.75 -171.4 2.71 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 122.816 0.446 . . . . 0.0 110.401 -175.325 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . . . . . . . . . 39.9 mt -114.88 163.91 14.87 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.943 0.897 . . . . 0.0 109.96 168.909 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 13.8 tp -152.18 103.05 2.83 Favored 'General case' 0 CA--C 1.542 0.644 0 N-CA-C 109.11 -0.7 . . . . 0.0 109.11 174.0 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -90.96 102.15 14.92 Favored 'General case' 0 N--CA 1.477 0.923 0 N-CA-C 107.643 -1.243 . . . . 0.0 107.643 178.915 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 74.4 p -118.04 153.72 33.23 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.957 0.903 . . . . 0.0 109.249 178.984 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.25 1.103 0 C-N-CA 123.339 0.655 . . . . 0.0 109.793 177.69 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.2 ptm . . . . . 0 N--CA 1.485 1.287 0 N-CA-C 111.489 0.181 . . . . 0.0 111.489 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.9 m -128.4 170.53 13.01 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 123.761 0.824 . . . . 0.0 110.165 -179.073 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . . . . . . . . . 87.2 mtt180 68.89 5.67 5.14 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 125.417 1.487 . . . . 0.0 113.16 176.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . . . . . . . . . 69.8 mtm -121.0 14.9 11.56 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.8 0.84 . . . . 0.0 112.018 -172.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 31.8 t70 -151.29 136.14 17.28 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.165 0.586 . . . . 0.0 110.209 178.285 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 3.7 p-10 -106.33 168.17 9.33 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.988 0.915 . . . . 0.0 110.805 179.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.8 p -70.41 159.87 33.39 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.797 0.839 . . . . 0.0 112.272 179.203 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -61.57 142.68 56.94 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.429 1.091 . . . . 0.0 111.161 177.271 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.5 mt -107.52 92.05 7.96 Favored Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 124.093 0.957 . . . . 0.0 108.506 173.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 39.5 Cg_endo -85.4 -164.38 0.23 Allowed 'Trans proline' 0 C--N 1.375 1.947 0 C-N-CA 122.921 2.414 . . . . 0.0 112.002 -176.423 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 63.3 94.33 0.05 OUTLIER Pre-proline 0 CA--C 1.551 1.013 0 C-N-CA 124.922 1.289 . . . . 0.0 110.779 177.172 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 80.6 Cg_endo -79.06 179.85 6.1 Favored 'Trans proline' 0 C--N 1.369 1.645 0 C-N-CA 122.583 2.189 . . . . 0.0 111.898 -179.659 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -88.75 172.16 9.43 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.363 0.665 . . . . 0.0 109.23 174.701 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 41.0 mt-10 -66.79 103.8 1.19 Allowed 'General case' 0 CA--C 1.55 0.973 0 N-CA-C 109.053 -0.721 . . . . 0.0 109.053 176.226 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 56.8 mt -63.01 86.88 0.04 OUTLIER 'Isoleucine or valine' 0 N--CA 1.481 1.095 0 C-N-CA 124.43 1.092 . . . . 0.0 111.368 -169.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 28.2 t70 58.25 -82.8 0.02 OUTLIER 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 125.056 1.343 . . . . 0.0 111.399 -176.287 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 12.3 t-20 -158.97 27.18 0.21 Allowed 'General case' 0 N--CA 1.488 1.468 0 CA-C-O 122.297 1.046 . . . . 0.0 109.19 176.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -97.4 109.07 21.9 Favored 'General case' 0 C--O 1.241 0.636 0 CA-C-N 114.915 -1.039 . . . . 0.0 109.217 -176.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 11.2 t -74.34 172.74 11.32 Favored 'General case' 0 CA--C 1.549 0.924 0 C-N-CA 123.162 0.585 . . . . 0.0 110.371 178.916 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 74.3 mt -88.94 -155.69 0.35 Allowed 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.854 0.861 . . . . 0.0 110.744 -176.978 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -58.58 147.6 69.38 Favored Pre-proline 0 N--CA 1.485 1.325 0 C-N-CA 123.724 0.81 . . . . 0.0 111.631 179.155 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 71.7 Cg_endo -71.63 168.32 23.99 Favored 'Trans proline' 0 C--N 1.383 2.369 0 C-N-CA 122.972 2.448 . . . . 0.0 112.254 177.367 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -75.23 -58.33 3.35 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 122.865 0.466 . . . . 0.0 110.962 -176.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -164.11 148.03 9.82 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 123.69 0.796 . . . . 0.0 110.375 -179.572 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . 0.458 ' HB3' ' NH1' ' A' ' 27' ' ' ARG . 48.7 mt-10 -113.8 35.53 4.04 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.716 0.806 . . . . 0.0 109.702 174.358 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . 0.447 ' HG3' HG13 ' A' ' 28' ' ' VAL . 14.3 tpt180 -82.82 85.39 7.1 Favored 'General case' 0 CA--C 1.549 0.911 0 CA-C-N 115.084 -0.962 . . . . 0.0 109.539 178.058 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . 0.458 ' NH1' ' HB3' ' A' ' 25' ' ' GLU . 6.5 mpt_? -74.28 94.67 2.53 Favored 'General case' 0 N--CA 1.481 1.081 0 CA-C-O 121.135 0.493 . . . . 0.0 109.855 179.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . 0.447 HG13 ' HG3' ' A' ' 26' ' ' ARG . 34.6 m -107.81 172.3 2.04 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.673 0 C-N-CA 124.863 1.265 . . . . 0.0 108.377 171.459 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.429 ' HA ' ' HB3' ' A' ' 43' ' ' ASP . 5.0 m-20 -69.15 165.35 20.59 Favored 'General case' 0 N--CA 1.484 1.272 0 C-N-CA 122.94 0.496 . . . . 0.0 111.497 176.522 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 23.0 t -59.24 -32.4 69.94 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.939 0.895 . . . . 0.0 110.991 168.959 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -55.94 -33.88 65.14 Favored 'General case' 0 N--CA 1.482 1.152 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.059 173.764 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -107.95 35.08 3.26 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 124.125 0.97 . . . . 0.0 111.046 -179.128 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 pt? -46.78 -20.18 0.12 Allowed 'General case' 0 N--CA 1.498 1.929 0 N-CA-C 115.471 1.656 . . . . 0.0 115.471 -175.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.475 HD22 ' HG3' ' A' ' 53' ' ' LYS . 95.2 mt -130.89 -56.65 1.05 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.299 0.64 . . . . 0.0 109.761 172.993 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 68.83 -158.05 53.07 Favored Glycine 0 CA--C 1.529 0.945 0 CA-C-N 115.004 -0.998 . . . . 0.0 113.037 -177.23 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -76.76 -10.31 18.4 Favored 'Trans proline' 0 C--N 1.372 1.805 0 C-N-CA 122.873 2.382 . . . . 0.0 112.274 173.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -75.0 -51.87 12.53 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.787 0.835 . . . . 0.0 109.5 179.605 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.69 0.1 88.86 Favored Glycine 0 C--N 1.349 1.26 0 CA-C-N 114.925 -1.034 . . . . 0.0 112.851 -176.199 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -154.14 98.05 2.11 Favored 'General case' 0 CA--C 1.546 0.823 0 N-CA-C 107.891 -1.151 . . . . 0.0 107.891 -178.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 26.9 m -143.29 166.62 14.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.966 0 C-N-CA 122.945 0.498 . . . . 0.0 110.929 -173.625 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 43.7 mt -98.31 117.7 43.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.966 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.136 168.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.511 ' O ' ' HA ' ' A' ' 48' ' ' GLU . 1.5 mp -67.79 133.47 31.58 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.316 0 C-N-CA 125.854 1.662 . . . . 0.0 110.112 174.746 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . 0.429 ' HB3' ' HA ' ' A' ' 29' ' ' ASN . 19.2 t70 -104.25 113.3 26.76 Favored 'General case' 0 C--O 1.247 0.968 0 N-CA-C 107.288 -1.375 . . . . 0.0 107.288 170.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 17.8 t-80 -155.15 113.8 3.54 Favored 'General case' 0 N--CA 1.476 0.827 0 O-C-N 123.397 0.436 . . . . 0.0 111.092 -175.421 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 59.67 36.98 22.54 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 125.414 1.486 . . . . 0.0 110.646 172.615 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 89.64 -25.01 12.07 Favored Glycine 0 C--N 1.346 1.129 0 CA-C-N 115.669 -0.696 . . . . 0.0 113.442 179.026 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 78.7 mt-30 -91.99 156.79 17.19 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 122.949 0.5 . . . . 0.0 110.03 -177.602 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . 0.511 ' HA ' ' O ' ' A' ' 42' ' ' ILE . 13.7 pt-20 -134.5 129.73 35.6 Favored 'General case' 0 CA--C 1.549 0.91 0 CA-C-N 115.898 -0.592 . . . . 0.0 110.337 -174.836 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER -134.19 133.29 40.76 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 122.4 -0.187 . . . . 0.0 110.508 -175.103 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -77.61 110.98 12.88 Favored 'General case' 0 CA--C 1.548 0.902 0 N-CA-C 108.765 -0.828 . . . . 0.0 108.765 173.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.496 HD11 ' HB3' ' A' ' 59' ' ' LEU . 60.9 tp -108.07 127.12 53.51 Favored 'General case' 0 N--CA 1.468 0.44 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 170.173 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -130.94 144.73 51.69 Favored 'General case' 0 CA--C 1.535 0.394 0 CA-C-O 121.093 0.473 . . . . 0.0 110.342 179.363 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.475 ' HG3' HD22 ' A' ' 34' ' ' LEU . 60.3 mtpt -83.75 98.53 9.74 Favored 'General case' 0 C--O 1.234 0.276 0 N-CA-C 107.494 -1.298 . . . . 0.0 107.494 169.839 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 30.6 p -63.78 139.64 58.79 Favored 'General case' 0 C--O 1.246 0.901 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 176.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 14.2 pt20 -64.92 -12.66 51.8 Favored 'General case' 0 N--CA 1.487 1.397 0 O-C-N 124.431 1.082 . . . . 0.0 112.331 -176.092 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -68.64 -13.36 62.3 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.52 0.728 . . . . 0.0 111.569 171.207 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 97.02 37.74 4.56 Favored Glycine 0 C--N 1.349 1.288 0 CA-C-N 115.575 -0.738 . . . . 0.0 112.153 179.54 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . . . . . . . . . 37.9 mtmt -132.36 165.25 24.65 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 122.669 0.388 . . . . 0.0 110.402 -175.157 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.496 ' HB3' HD11 ' A' ' 51' ' ' LEU . 76.1 mt -100.97 142.3 32.64 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.725 0.81 . . . . 0.0 109.158 167.532 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 15.4 tp -130.97 104.18 6.97 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 108.772 -0.825 . . . . 0.0 108.772 -179.079 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -93.29 101.59 13.84 Favored 'General case' 0 N--CA 1.476 0.857 0 N-CA-C 107.851 -1.166 . . . . 0.0 107.851 179.081 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 76.5 p -115.91 152.44 33.44 Favored 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 124.563 1.145 . . . . 0.0 109.355 178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.422 ' HD3' ' N ' ' A' ' 63' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.557 1.247 0 C-N-CA 123.785 0.834 . . . . 0.0 108.802 -177.539 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.482 1.159 0 CA-C-O 120.849 0.356 . . . . 0.0 110.288 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 39.2 t -84.32 173.23 11.12 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.33 0.652 . . . . 0.0 109.258 171.652 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.593 ' HG3' ' SD ' ' A' ' 4' ' ' MET . 21.8 tpt180 -127.41 -89.24 0.54 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 108.051 -1.092 . . . . 0.0 108.051 175.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' MET . . . . . 0.593 ' SD ' ' HG3' ' A' ' 3' ' ' ARG . 1.9 mpt? -139.48 108.48 6.02 Favored 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 123.889 0.876 . . . . 0.0 108.657 175.306 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ASP . . . . . . . . . . . . . 6.7 p-10 -165.48 167.22 17.75 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.573 0.749 . . . . 0.0 110.575 178.149 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -163.63 155.21 16.89 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 123.679 0.792 . . . . 0.0 110.0 179.157 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 19.4 p -64.14 104.88 0.79 Allowed 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.989 0.916 . . . . 0.0 111.124 176.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -126.03 -170.33 2.17 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 124.496 1.119 . . . . 0.0 109.521 179.213 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.1 mt 67.23 102.33 0.04 OUTLIER Pre-proline 0 N--CA 1.487 1.388 0 C-N-CA 124.419 1.088 . . . . 0.0 109.949 -177.04 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' PRO . . . . . . . . . . . . . 69.2 Cg_endo -68.87 139.68 44.05 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.676 2.251 . . . . 0.0 112.165 -173.352 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' HIS . . . . . . . . . . . . . 53.9 m80 -77.33 133.23 68.25 Favored Pre-proline 0 CA--C 1.541 0.602 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 175.941 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 48.1 Cg_exo -57.85 134.17 60.82 Favored 'Trans proline' 0 C--N 1.378 2.084 0 C-N-CA 122.875 2.383 . . . . 0.0 112.41 177.273 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 21.3 ttmm -111.49 16.44 20.74 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.115 0.966 . . . . 0.0 110.028 -176.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 68.92 118.04 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 124.867 1.267 . . . . 0.0 110.385 -173.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 35.4 mt -84.57 68.31 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 N-CA-C 108.636 -0.876 . . . . 0.0 108.636 179.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.8 t70 68.3 148.13 0.06 Allowed 'General case' 0 N--CA 1.49 1.569 0 C-N-CA 125.585 1.554 . . . . 0.0 111.12 -175.367 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 22.7 t-20 -83.9 86.79 7.12 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 177.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -99.33 149.26 23.32 Favored 'General case' 0 N--CA 1.471 0.598 0 CA-C-N 115.89 -0.596 . . . . 0.0 110.847 -179.484 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.0 t -158.49 151.51 22.59 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.232 -0.895 . . . . 0.0 109.084 179.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . . . . . . . . . 96.8 mt -87.95 159.84 18.16 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 167.896 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LEU . . . . . . . . . . . . . 89.4 mt -117.21 95.0 46.43 Favored Pre-proline 0 C--O 1.242 0.681 0 CA-C-N 115.416 -0.811 . . . . 0.0 109.183 -179.22 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 20.9 Cg_exo -65.38 -75.85 0.02 OUTLIER 'Trans proline' 0 C--N 1.381 2.263 0 C-N-CA 122.484 2.123 . . . . 0.0 110.614 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . 174.31 -56.43 0.01 OUTLIER 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 124.979 1.312 . . . . 0.0 108.503 177.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -158.58 128.91 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-N 115.072 -0.967 . . . . 0.0 110.107 -178.503 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -86.24 79.46 9.07 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.739 0.816 . . . . 0.0 109.94 177.547 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -142.42 96.15 2.9 Favored 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.794 -1.094 . . . . 0.0 108.93 -178.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' ARG . . . . . . . . . . . . . 22.7 mtm105 -85.32 96.95 9.69 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-O 121.212 0.53 . . . . 0.0 109.937 -178.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' VAL . . . . . . . . . . . . . 15.4 m -112.8 168.6 5.19 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 124.375 1.07 . . . . 0.0 108.899 171.662 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -57.26 159.51 4.52 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 123.512 0.725 . . . . 0.0 111.758 177.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 51.9 p -56.85 -27.39 60.26 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.901 0.88 . . . . 0.0 111.544 168.898 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' GLN . . . . . . . . . . . . . 45.1 mt-30 -58.94 -37.3 76.4 Favored 'General case' 0 CA--C 1.55 0.975 0 C-N-CA 123.863 0.865 . . . . 0.0 110.884 174.843 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ALA . . . . . . . . . . . . . . . -106.26 37.09 2.37 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.666 0.786 . . . . 0.0 110.869 174.672 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.524 ' HG ' ' HG ' ' A' ' 34' ' ' LEU . 2.4 pt? -49.55 -20.29 0.73 Allowed 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 115.055 1.502 . . . . 0.0 115.055 -178.148 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LEU . . . . . 0.531 HD13 ' HD2' ' A' ' 53' ' ' LYS . 94.6 mt -126.22 -42.6 1.84 Allowed 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.13 0.572 . . . . 0.0 110.299 177.51 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 64.66 -158.9 43.18 Favored Glycine 0 CA--C 1.534 1.254 0 CA-C-N 115.007 -0.997 . . . . 0.0 112.993 -176.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . . . . . . . . . 89.4 Cg_endo -79.07 -4.99 14.27 Favored 'Trans proline' 0 C--N 1.367 1.552 0 C-N-CA 122.641 2.227 . . . . 0.0 112.189 173.634 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -86.89 -33.52 19.72 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 124.582 1.153 . . . . 0.0 110.876 -178.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 78.65 -4.32 60.83 Favored Glycine 0 CA--C 1.533 1.192 0 CA-C-N 115.505 -0.771 . . . . 0.0 112.81 -173.356 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -153.24 105.07 2.84 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.692 0.797 . . . . 0.0 110.357 -175.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 29.9 m -148.55 171.54 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.247 0 C-N-CA 123.663 0.785 . . . . 0.0 110.05 -178.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ILE . . . . . . . . . . . . . 63.0 mt -89.5 119.35 36.46 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.986 0 C-N-CA 123.247 0.619 . . . . 0.0 109.799 173.644 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.69 137.62 23.78 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.42 0 C-N-CA 125.498 1.519 . . . . 0.0 109.263 172.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' ASP . . . . . . . . . . . . . 25.4 t70 -126.01 122.39 35.74 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.475 -1.306 . . . . 0.0 107.475 170.852 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' HIS . . . . . . . . . . . . . 58.7 t-80 -158.0 110.56 2.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 122.783 0.433 . . . . 0.0 111.101 -177.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 59.37 30.94 20.71 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 125.015 1.326 . . . . 0.0 111.6 173.256 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' GLY . . . . . . . . . . . . . . . 96.32 -18.98 56.49 Favored Glycine 0 C--N 1.343 0.934 0 CA-C-N 115.797 -0.638 . . . . 0.0 113.675 179.161 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLN . . . . . . . . . . . . . 39.1 mt-30 -91.25 128.6 37.13 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 109.414 -0.588 . . . . 0.0 109.414 179.639 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLU . . . . . . . . . . . . . 16.1 pt-20 -124.8 135.47 52.97 Favored 'General case' 0 C--O 1.238 0.487 0 C-N-CA 123.476 0.71 . . . . 0.0 109.97 -176.26 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 0.9 OUTLIER -139.01 164.43 29.78 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 108.998 -0.741 . . . . 0.0 108.998 -179.541 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 3.4 tm? -103.63 126.62 50.89 Favored 'General case' 0 N--CA 1.479 1.002 0 N-CA-C 107.438 -1.319 . . . . 0.0 107.438 170.237 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.504 HD11 ' HB3' ' A' ' 59' ' ' LEU . 37.3 tp -120.36 122.1 40.05 Favored 'General case' 0 C--O 1.242 0.683 0 N-CA-C 107.964 -1.124 . . . . 0.0 107.964 170.73 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -122.12 138.6 54.4 Favored 'General case' 0 CA--C 1.531 0.223 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.638 177.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LYS . . . . . 0.531 ' HD2' HD13 ' A' ' 34' ' ' LEU . 9.0 mtpm? -82.72 117.3 22.55 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.415 -0.957 . . . . 0.0 108.415 171.583 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.496 ' OG1' ' HB2' ' A' ' 58' ' ' LYS . 23.6 p -74.87 147.65 40.88 Favored 'General case' 0 C--O 1.246 0.917 0 N-CA-C 108.879 -0.785 . . . . 0.0 108.879 178.703 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLN . . . . . . . . . . . . . 46.0 mt-30 -67.14 -12.99 61.51 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 124.048 0.939 . . . . 0.0 111.93 -177.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -69.6 -6.54 31.83 Favored 'General case' 0 CA--C 1.555 1.148 0 C-N-CA 123.884 0.874 . . . . 0.0 111.859 170.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' GLY . . . . . . . . . . . . . . . 88.23 37.94 7.47 Favored Glycine 0 C--N 1.355 1.613 0 N-CA-C 111.352 -0.699 . . . . 0.0 111.352 179.59 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' LYS . . . . . 0.496 ' HB2' ' OG1' ' A' ' 54' ' ' THR . 54.8 mtpt -136.54 -169.5 2.47 Favored 'General case' 0 N--CA 1.485 1.301 0 C-N-CA 123.418 0.687 . . . . 0.0 110.405 -171.636 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LEU . . . . . 0.504 ' HB3' HD11 ' A' ' 51' ' ' LEU . 78.6 mt -118.33 166.38 12.7 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.753 1.221 . . . . 0.0 109.979 176.906 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LEU . . . . . . . . . . . . . 12.5 tp -153.43 103.75 2.69 Favored 'General case' 0 CA--C 1.547 0.833 0 N-CA-C 108.754 -0.832 . . . . 0.0 108.754 172.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -93.99 101.76 13.82 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 108.471 -0.937 . . . . 0.0 108.471 -177.664 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' THR . . . . . . . . . . . . . 71.6 p -118.03 133.31 56.03 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.208 1.003 . . . . 0.0 109.861 -177.25 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 109.012 -0.736 . . . . 0.0 109.012 174.853 . . . . . . . . 1 1 . 1 stop_ save_