data_2m9a_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 2m9a _Structure_validation_residue.Date_analyzed 2016-10-08 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.791 0.805 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -121.09 81.24 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-N 114.7 -1.137 . . . . 0.0 108.521 -173.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -78.64 110.23 13.57 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.962 -174.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.7 mm -109.19 131.78 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.774 0.83 . . . . 0.0 109.179 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.735 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 36.2 t -90.13 52.81 2.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.394 1.077 . . . . 0.0 109.025 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 56.76 -53.12 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 126.988 2.115 . . . . 0.0 115.48 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -134.44 -45.23 0.76 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.017 1.327 . . . . 0.0 109.817 -166.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.5 p -107.2 37.39 2.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.529 -167.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.735 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -142.68 122.93 13.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.193 0.597 . . . . 0.0 109.416 160.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -67.13 -55.65 13.3 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.413 1.071 . . . . 0.0 109.996 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.55 130.06 0.55 Allowed 'General case' 0 C--N 1.355 0.831 0 C-N-CA 124.036 0.934 . . . . 0.0 109.621 161.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -110.48 154.9 23.0 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.599 ' HB3' ' HZ1' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -100.0 5.58 45.12 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -152.14 139.92 19.91 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.311 0.645 . . . . 0.0 109.55 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.456 ' HA ' HD22 ' A' ' 29' ' ' LEU . 32.3 t -52.56 -38.9 60.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.599 1.16 . . . . 0.0 111.958 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 31' ' ' VAL . 29.6 t-80 -69.84 -39.22 76.56 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.67 0.388 . . . . 0.0 111.345 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -56.86 -47.84 79.46 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.592 0.71 . . . . 0.0 110.911 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.67 HD13 HH11 ' A' ' 33' ' ' ARG . 0.2 OUTLIER -63.99 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.582 175.376 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.42 -27.86 68.84 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.866 0.866 . . . . 0.0 112.162 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.585 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 70.9 t -61.11 -45.2 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 124.039 0.935 . . . . 0.0 110.666 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.26 -36.65 74.59 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.967 0.507 . . . . 0.0 110.438 173.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.67 HH11 HD13 ' A' ' 29' ' ' LEU . 13.4 ttt180 -68.76 6.82 0.77 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.308 1.043 . . . . 0.0 112.608 -170.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptm -45.91 -15.67 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 125.901 1.681 . . . . 0.0 114.743 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.08 -54.32 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.309 0 C-N-CA 124.941 1.297 . . . . 0.0 109.05 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.513 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -107.3 2.03 24.25 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 -173.666 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.0 t -82.29 -41.43 20.16 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 120.058 1.299 . . . . 0.0 113.81 -165.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.04 -31.26 8.76 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.155 0.422 . . . . 0.0 114.155 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -84.37 -51.26 7.1 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 117.231 0.516 . . . . 0.0 110.226 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 67.17 99.8 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.693 1.597 . . . . 0.0 111.546 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.585 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 73.9 Cg_endo -69.87 -147.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.985 2.457 . . . . 0.0 111.905 170.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.0 mt -129.32 116.95 19.86 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.739 -0.6 . . . . 0.0 111.726 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -108.98 142.74 39.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.953 0.901 . . . . 0.0 109.334 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.473 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 13.5 t -64.49 112.18 3.02 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 124.702 1.201 . . . . 0.0 109.689 170.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -79.52 29.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.0 1.32 . . . . 0.0 111.77 -174.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.473 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 2.8 mp -119.95 -16.0 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 124.494 1.118 . . . . 0.0 108.759 -173.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 1.4 p -175.97 -134.29 0.01 OUTLIER 'General case' 0 C--O 1.245 0.852 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 -156.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.552 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.94 131.48 4.14 Favored Glycine 0 C--N 1.309 -0.95 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 169.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 39.5 t80 176.9 113.37 0.03 OUTLIER 'General case' 0 C--N 1.349 0.573 0 N-CA-C 101.954 -3.35 . . . . 0.0 101.954 -175.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.0 m -128.73 139.99 51.95 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -166.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.526 ' SG ' ' HB3' ' A' ' 57' ' ' LEU . 19.3 p -153.78 166.06 34.06 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.166 -174.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -88.88 -31.07 18.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.264 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 138.0 38.63 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.699 0.8 . . . . 0.0 109.121 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -36.05 82.59 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -174.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.39 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -55.49 -47.91 75.42 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 -173.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.526 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 2.0 pt? -76.41 -37.44 57.07 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.487 0.585 . . . . 0.0 111.044 173.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.407 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 7.1 t30 -52.8 -44.61 66.74 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.808 0.843 . . . . 0.0 113.034 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.419 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 100.0 m95 -80.9 -36.92 30.55 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.74 -177.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.406 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 58.5 t60 -53.84 -33.33 55.93 Favored 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 165.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.432 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 68.2 mtm -72.82 -37.86 67.35 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.449 0.568 . . . . 0.0 110.425 174.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -59.01 -34.16 71.55 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.808 0.843 . . . . 0.0 111.281 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 33.8 mmtp -56.87 -28.78 62.22 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.641 172.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 122.67 0.388 . . . . 0.0 110.745 179.011 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -95.3 124.64 39.44 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 167.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -54.11 -39.29 66.26 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.296 0.569 . . . . 0.0 111.692 176.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 mt -86.12 -47.49 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.5 -166.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 20.3 p -126.99 3.42 6.53 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 119.319 0.963 . . . . 0.0 112.697 -175.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 52.61 37.87 51.21 Favored Glycine 0 C--N 1.361 1.972 0 N-CA-C 114.783 0.673 . . . . 0.0 114.783 174.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -30.29 71.4 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 122.83 0.452 . . . . 0.0 111.276 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt 75.11 122.34 0.04 OUTLIER 'General case' 0 C--N 1.36 1.045 0 C-N-CA 125.04 1.336 . . . . 0.0 109.587 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -130.86 162.91 28.58 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.551 0.741 . . . . 0.0 111.717 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.75 -44.46 96.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.399 1.08 . . . . 0.0 111.855 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.471 ' HG3' ' HB2' ' A' ' 85' ' ' ASP . 5.5 ptmm? -140.99 156.33 46.06 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.353 0.661 . . . . 0.0 109.729 -173.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -60.85 -31.56 70.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.328 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.471 ' HB2' ' HG3' ' A' ' 83' ' ' LYS . 8.3 m-20 -56.32 -43.05 78.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.528 0.731 . . . . 0.0 111.688 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.4 m -64.54 -31.56 72.82 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.033 0.533 . . . . 0.0 111.389 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.8 t -75.66 -46.14 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.153 0.501 . . . . 0.0 110.479 -176.517 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 75.9 t -70.92 -38.04 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.15 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.88 90.76 Favored 'General case' 0 C--N 1.349 0.551 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.582 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -70.26 -37.61 74.95 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.881 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.81 -38.45 67.18 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.456 0.702 . . . . 0.0 109.787 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.83 -23.08 65.99 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.983 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -102.75 -49.29 3.85 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.6 t -88.48 -6.93 57.32 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.229 1.011 . . . . 0.0 111.607 -170.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 . . . . . 0 N--CA 1.478 0.952 0 C-N-CA 122.797 0.439 . . . . 0.0 110.2 179.164 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 122.069 0.937 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -144.64 100.21 3.48 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -172.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -86.64 104.48 16.1 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.454 HG21 ' HB2' ' A' ' 20' ' ' ALA . 29.4 mm -111.12 133.12 57.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 -173.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.469 ' HA ' HD12 ' A' ' 29' ' ' LEU . 41.8 t -54.96 -53.0 61.28 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.853 0.861 . . . . 0.0 110.865 174.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 172.15 -53.75 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.972 1.309 . . . . 0.0 108.711 177.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -140.59 -45.69 0.41 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -175.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 p -88.03 64.64 7.88 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.581 -1.645 . . . . 0.0 109.703 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.454 ' HB2' HG21 ' A' ' 15' ' ' ILE . . . -157.7 134.0 9.59 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.063 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -81.16 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 166.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.41 124.86 1.46 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.653 0.781 . . . . 0.0 108.986 165.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.441 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 96.7 m-85 -102.34 150.59 23.18 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.64 0.776 . . . . 0.0 109.414 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -76.19 -17.24 59.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.847 0.459 . . . . 0.0 112.167 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -146.88 150.36 35.07 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.054 0.541 . . . . 0.0 110.701 -174.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 66.5 p -58.73 -34.21 71.09 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.408 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -74.02 -35.49 64.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.763 0.825 . . . . 0.0 110.955 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.441 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -60.62 -48.41 81.89 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.623 0.769 . . . . 0.0 109.906 174.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -66.6 -35.07 79.3 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.619 177.136 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.14 68.04 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.29 0.994 . . . . 0.0 111.88 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -56.62 -49.99 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 124.199 1.0 . . . . 0.0 111.411 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -34.9 65.99 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.398 0.618 . . . . 0.0 109.559 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.534 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 63.6 ttt180 -63.73 -7.76 8.55 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.682 -175.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptm -43.97 -15.19 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.25 -50.42 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.675 0 C-N-CA 124.559 1.143 . . . . 0.0 109.762 175.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.61 10.58 38.65 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 125.009 1.323 . . . . 0.0 112.36 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 9.0 t -55.91 -67.41 0.29 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -155.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . 0.415 ' H ' HG23 ' A' ' 37' ' ' THR . . . 69.81 36.56 74.63 Favored Glycine 0 N--CA 1.473 1.147 0 CA-C-N 118.644 0.656 . . . . 0.0 112.383 -176.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -169.74 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.302 1.441 . . . . 0.0 108.181 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 66.53 97.92 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.166 1.386 . . . . 0.0 113.555 164.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.51 164.33 26.22 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.099 1.866 . . . . 0.0 110.046 160.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.93 121.32 42.88 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.574 0.75 . . . . 0.0 109.17 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -109.57 143.53 39.14 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -174.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.401 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 14.5 t -69.57 109.68 4.42 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.725 0.81 . . . . 0.0 109.375 176.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 40.63 0.96 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.779 0.832 . . . . 0.0 110.428 -178.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.401 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.7 mp -130.97 -12.78 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 C-N-CA 124.945 1.298 . . . . 0.0 108.356 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 4.8 p -175.57 -124.33 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 N-CA-C 102.693 -3.077 . . . . 0.0 102.693 -167.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.554 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.95 134.69 4.95 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 117.251 -1.86 . . . . 0.0 108.638 163.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.8 t80 177.57 115.95 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 102.538 -3.134 . . . . 0.0 102.538 -176.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 m -110.48 146.19 36.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.504 0.669 . . . . 0.0 109.724 -171.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.566 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 43.6 t -144.83 -170.95 3.52 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 125.675 1.59 . . . . 0.0 107.886 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 14.5 ptm180 -131.94 -19.96 2.54 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.694 0.798 . . . . 0.0 110.717 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.596 HE22 ' HB2' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -102.26 125.06 48.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.173 0.989 . . . . 0.0 108.353 -179.329 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -52.9 -56.08 18.57 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.472 1.109 . . . . 0.0 113.266 -172.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.596 ' HB2' HE22 ' A' ' 53' ' ' GLN . . . -53.71 -39.66 65.4 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.048 0.539 . . . . 0.0 112.193 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.566 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 23.5 t -54.75 -55.74 26.71 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.429 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.0 pt? -74.07 -26.31 60.32 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.042 0.383 . . . . 0.0 110.866 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.449 ' O ' ' HG2' ' A' ' 61' ' ' MET . 6.0 t30 -62.88 -25.11 68.14 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.609 0.764 . . . . 0.0 112.126 169.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.2 m95 -82.62 -39.1 22.63 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.544 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 63.1 t60 -58.33 -31.12 67.25 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 169.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.449 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 26.2 ptm -71.7 -31.44 66.75 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 119.496 1.044 . . . . 0.0 110.329 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -61.29 -32.67 72.52 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.126 0.571 . . . . 0.0 111.311 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.544 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 27.5 mmmt -62.66 -35.86 81.0 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.832 170.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 . . . . . 0 N--CA 1.494 1.729 0 C-N-CA 123.244 0.617 . . . . 0.0 111.584 170.161 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.593 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 13.3 p . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.469 0.652 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.8 t -109.55 115.35 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -67.75 -14.64 63.12 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.469 HD13 ' HE3' ' A' ' 91' ' ' LYS . 2.6 mt -90.06 -38.6 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.423 0.689 . . . . 0.0 112.078 -174.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -137.76 -1.72 2.0 Allowed 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.59 38.78 93.58 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 113.895 0.318 . . . . 0.0 113.895 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -40.47 92.07 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 122.923 0.489 . . . . 0.0 111.672 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.593 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 14.0 mptt 72.54 116.81 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.947 1.299 . . . . 0.0 111.034 -177.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -125.1 163.67 21.89 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.854 0.862 . . . . 0.0 111.176 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -73.66 -44.85 55.67 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.741 0.816 . . . . 0.0 112.419 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -145.7 163.4 35.02 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.727 0.411 . . . . 0.0 111.793 -167.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -49.67 -39.35 36.21 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 125.488 1.515 . . . . 0.0 112.062 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.91 -46.25 67.93 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.458 1.099 . . . . 0.0 111.154 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -71.98 -35.75 69.6 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.517 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -75.28 -51.04 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 123.963 0.905 . . . . 0.0 111.345 -170.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.01 -34.38 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.257 -172.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.92 88.57 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.304 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.18 -33.7 67.88 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.998 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE3' HD13 ' A' ' 76' ' ' ILE . 87.2 tttt -73.12 -44.36 60.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.322 0.582 . . . . 0.0 110.171 -178.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.76 -22.54 67.01 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.768 -1.105 . . . . 0.0 112.174 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -106.35 -50.19 3.2 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.1 t -90.66 -9.3 47.38 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.52 0.728 . . . . 0.0 111.49 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.8 m-70 . . . . . 0 N--CA 1.484 1.266 0 C-N-CA 123.295 0.638 . . . . 0.0 110.634 178.881 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -129.25 83.27 2.13 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -170.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -97.8 120.89 39.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.573 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.583 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -118.42 157.87 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.067 0.947 . . . . 0.0 109.147 -164.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.632 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 46.9 t -96.74 -12.37 23.82 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.186 0.594 . . . . 0.0 110.744 176.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.583 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.5 tt0 97.59 -20.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 126.513 1.925 . . . . 0.0 111.065 167.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -135.9 -51.5 0.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.871 0.843 . . . . 0.0 109.138 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.9 p -121.17 72.67 1.0 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.464 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.632 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -168.03 145.74 4.32 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.966 0.889 . . . . 0.0 112.694 163.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.13 -168.23 1.05 Allowed 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 113.318 -1.764 . . . . 0.0 109.377 162.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.75 125.44 30.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.19 0.596 . . . . 0.0 109.823 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.593 ' HE1' ' HB3' ' A' ' 20' ' ' ALA . 77.1 m-85 -111.53 148.88 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.742 0.817 . . . . 0.0 109.044 174.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -61.98 -30.17 70.76 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.091 0.556 . . . . 0.0 111.669 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 53.1 m -144.85 151.06 38.18 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.32 0.648 . . . . 0.0 110.83 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.512 ' HA ' HD21 ' A' ' 29' ' ' LEU . 34.4 t -57.55 -37.11 72.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.871 0.868 . . . . 0.0 111.462 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 -69.54 -35.25 75.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.028 0.931 . . . . 0.0 111.98 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.92 -45.88 91.77 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.462 0.648 . . . . 0.0 110.643 174.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -68.36 -29.54 68.28 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.676 174.274 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.75 -26.31 68.63 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.349 0.66 . . . . 0.0 111.568 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 64.1 t -61.84 -47.64 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 122.845 0.458 . . . . 0.0 110.241 171.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -62.32 -38.4 89.29 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.732 0.813 . . . . 0.0 110.407 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -65.29 2.37 0.86 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.733 1.213 . . . . 0.0 112.214 -175.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.1 ptp -44.81 -19.48 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 125.209 1.404 . . . . 0.0 113.425 171.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.9 tp -86.52 -51.02 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 125.538 1.535 . . . . 0.0 110.572 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.87 5.33 40.93 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 123.451 0.7 . . . . 0.0 112.235 -173.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.7 t -59.32 -57.33 13.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -164.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.67 -31.66 2.18 Favored Glycine 0 CA--C 1.538 1.53 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 -169.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.43 -45.82 57.87 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 109.91 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt 66.42 98.3 0.04 OUTLIER Pre-proline 0 C--N 1.357 0.932 0 O-C-N 124.918 1.386 . . . . 0.0 111.072 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -70.68 -170.89 0.49 Allowed 'Trans proline' 0 C--N 1.382 2.339 0 C-N-CA 122.899 2.399 . . . . 0.0 111.391 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.478 HD12 ' HB3' ' A' ' 54' ' ' LYS . 39.8 mt -99.02 119.37 37.67 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -172.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -135.45 144.38 46.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 122.716 0.407 . . . . 0.0 111.542 -171.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 6.6 t -64.93 107.7 1.56 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.174 0.989 . . . . 0.0 110.684 174.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.62 14.58 1.25 Allowed 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.175 0.99 . . . . 0.0 112.551 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.457 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 32.3 mm -96.53 -53.66 7.88 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 20.1 p -119.65 -107.15 0.37 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.517 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.5 166.82 29.68 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 156.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.5 t80 168.45 111.26 0.01 OUTLIER 'General case' 0 C--N 1.346 0.452 0 N-CA-C 102.185 -3.265 . . . . 0.0 102.185 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -115.05 132.93 56.44 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.559 0.695 . . . . 0.0 109.214 -169.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.6 t -149.43 175.28 11.61 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.971 -1.468 . . . . 0.0 109.024 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.6 ppt_? -103.41 3.25 34.88 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.907 0.883 . . . . 0.0 110.891 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -127.9 103.74 7.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.046 0.938 . . . . 0.0 108.645 -174.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.478 ' HB3' HD12 ' A' ' 42' ' ' LEU . 21.0 ptmt -58.6 -28.83 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.568 0.747 . . . . 0.0 112.57 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.19 -39.79 70.01 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.926 0.89 . . . . 0.0 111.829 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.4 t -63.22 -54.64 34.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.768 0.827 . . . . 0.0 111.172 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.535 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -74.29 -27.67 60.83 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.98 0.512 . . . . 0.0 112.224 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 61' ' ' MET . 44.3 t30 -51.48 -51.66 53.16 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.603 0.761 . . . . 0.0 112.17 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -81.75 -32.41 31.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.564 0.221 . . . . 0.0 111.028 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.535 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 76.0 t60 -48.97 -42.43 37.65 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 163.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.499 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 17.2 ptm -70.99 -31.87 68.53 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 119.617 1.099 . . . . 0.0 111.604 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.253 0.621 . . . . 0.0 111.351 170.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -63.12 -36.51 83.84 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.624 0.369 . . . . 0.0 110.58 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.499 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.6 m-70 . . . . . 0 N--CA 1.485 1.315 0 C-N-CA 123.556 0.742 . . . . 0.0 109.86 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 C--O 1.233 0.23 0 CA-C-O 121.366 0.603 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.1 t -90.14 125.04 35.31 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 172.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -52.87 -30.68 35.26 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.815 0.846 . . . . 0.0 113.153 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -103.79 -30.92 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -163.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 18.8 p -136.85 -0.31 2.33 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.863 0.756 . . . . 0.0 112.099 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 59.56 34.35 81.04 Favored Glycine 0 C--N 1.358 1.779 0 N-CA-C 114.301 0.48 . . . . 0.0 114.301 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.435 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.6 tmtt? -63.37 -30.62 71.72 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.462 1.105 . . . . 0.0 112.442 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm 74.13 116.69 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.742 1.217 . . . . 0.0 111.28 175.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.32 159.37 38.08 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.693 0.797 . . . . 0.0 110.269 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.34 -31.18 67.07 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.422 0.689 . . . . 0.0 111.729 -177.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -134.04 148.06 51.02 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.55 -35.56 68.27 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.916 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.98 -45.96 71.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.149 0.979 . . . . 0.0 111.132 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 t -69.32 -28.36 66.18 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.043 0.537 . . . . 0.0 110.839 -176.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 87.0 t -70.57 -46.77 68.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.019 0.928 . . . . 0.0 109.967 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.1 t -71.93 -36.22 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.819 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.36 79.48 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.622 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -70.9 -34.55 71.68 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.529 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -38.53 71.1 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.089 0.956 . . . . 0.0 109.351 -174.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.51 -18.13 63.65 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.778 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -96.51 -49.78 5.0 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.422 0.689 . . . . 0.0 110.792 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.0 t -82.79 -32.31 27.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.255 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 . . . . . 0 CA--C 1.573 1.85 0 C-N-CA 122.761 0.424 . . . . 0.0 111.505 -171.702 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.413 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 3.2 p-10 -172.95 103.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.676 -172.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -84.76 124.85 32.01 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.334 0.654 . . . . 0.0 110.74 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.492 HG21 ' H ' ' A' ' 17' ' ' GLU . 5.3 mm -115.03 150.77 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 -172.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.614 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 t -83.97 -19.1 35.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.2 0.6 . . . . 0.0 109.492 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.492 ' H ' HG21 ' A' ' 15' ' ' ILE . 32.4 tt0 77.06 0.37 3.05 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.787 1.635 . . . . 0.0 110.701 173.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -136.16 -50.48 0.69 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.107 0.963 . . . . 0.0 108.612 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.36 77.05 1.53 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.56 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.614 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.52 137.37 2.26 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.942 0.897 . . . . 0.0 110.948 167.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 ptt180 -70.3 -77.95 0.08 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.337 168.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . -163.44 149.42 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.449 0.7 . . . . 0.0 110.233 171.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -126.83 152.63 46.73 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.379 0.671 . . . . 0.0 110.258 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -61.76 -32.62 72.89 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.63 0.772 . . . . 0.0 112.357 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -147.63 160.04 43.1 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.887 0.375 . . . . 0.0 111.118 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 p -56.68 -35.67 68.73 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.259 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -75.9 -35.55 59.77 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.0 0.92 . . . . 0.0 112.501 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -50.41 69.88 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.158 0.98 . . . . 0.0 109.041 169.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -60.02 -40.2 88.46 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 113.767 -1.56 . . . . 0.0 112.523 172.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.592 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -56.47 -26.9 55.54 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.617 0.767 . . . . 0.0 112.571 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.429 HG11 HG21 ' A' ' 50' ' ' THR . 85.5 t -60.35 -44.96 97.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 123.862 0.865 . . . . 0.0 110.681 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -72.15 -45.98 58.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.523 0.729 . . . . 0.0 110.769 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.592 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 29.8 ttt180 -63.39 -5.13 3.23 Favored 'General case' 0 C--O 1.212 -0.92 0 C-N-CA 125.779 1.632 . . . . 0.0 111.467 -174.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.5 ptm -47.44 -12.91 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 125.338 1.455 . . . . 0.0 114.69 173.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -83.99 -52.57 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.579 0 C-N-CA 124.715 1.206 . . . . 0.0 109.431 173.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -104.7 1.41 29.35 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.7 t -70.74 -49.61 45.04 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -165.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.94 -30.55 3.55 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-O 120.01 -0.328 . . . . 0.0 112.403 -164.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -103.8 76.87 1.41 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 124.713 1.205 . . . . 0.0 108.444 175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -52.79 131.56 47.59 Favored Pre-proline 0 CA--C 1.558 1.272 0 C-N-CA 123.333 0.653 . . . . 0.0 111.969 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.85 -172.87 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.568 2.179 . . . . 0.0 111.238 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.4 mt -103.06 99.36 9.24 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.51 134.15 55.31 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -166.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.403 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 23.2 t -74.66 106.65 6.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.896 0.878 . . . . 0.0 110.189 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.11 42.26 1.02 Allowed 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.164 0.983 . . . . 0.0 110.493 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.3 mp -127.78 -2.28 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.563 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 6.6 p 173.71 -136.79 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 -168.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.503 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -144.39 127.07 2.84 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.889 -2.084 . . . . 0.0 107.889 171.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.9 t80 179.7 112.02 0.04 OUTLIER 'General case' 0 C--O 1.237 0.434 0 N-CA-C 102.147 -3.279 . . . . 0.0 102.147 -167.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.429 HG21 HG11 ' A' ' 31' ' ' VAL . 2.9 m -123.56 144.96 49.24 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.612 0.72 . . . . 0.0 109.804 -170.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 81.6 m -147.26 171.16 15.84 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.696 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.456 ' HD2' ' H ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -117.42 -7.2 11.18 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.887 170.198 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -102.83 111.77 24.26 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 169.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -58.32 -33.88 69.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.604 0.761 . . . . 0.0 111.277 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.64 -42.82 71.72 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 124.456 1.098 . . . . 0.0 112.413 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -55.27 -53.78 51.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.967 0.907 . . . . 0.0 112.442 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.559 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 1.1 pt? -75.86 -27.39 57.78 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.066 0.547 . . . . 0.0 111.567 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.566 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 67.0 t30 -55.1 -44.76 75.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.783 0.833 . . . . 0.0 113.208 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.483 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 66.0 p-90 -82.52 -39.79 21.9 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 122.03 -0.419 . . . . 0.0 110.345 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.559 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 75.9 t60 -48.06 -35.25 10.9 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 171.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.566 ' HE2' ' HA ' ' A' ' 58' ' ' ASN . 23.7 ptp -70.03 -37.56 75.65 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 119.174 0.897 . . . . 0.0 111.043 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 19.4 ttmm -56.93 -37.11 71.04 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.872 0.869 . . . . 0.0 110.699 172.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -61.3 -31.39 71.23 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.654 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 . . . . . 0 N--CA 1.49 1.545 0 C-N-CA 123.302 0.641 . . . . 0.0 111.706 176.508 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.3 p . . . . . 0 C--O 1.24 0.566 0 CA-C-O 121.801 0.81 . . . . 0.0 111.133 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.66 117.4 30.04 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -67.41 -9.39 41.22 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.337 0.517 . . . . 0.0 112.299 -174.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . 0.612 HD13 ' HE3' ' A' ' 91' ' ' LYS . 3.2 mt -96.69 -37.39 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.199 0.6 . . . . 0.0 111.905 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.9 p -139.64 8.79 2.39 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 54.0 42.8 71.69 Favored Glycine 0 C--N 1.344 1.019 0 C-N-CA 123.884 0.755 . . . . 0.0 114.885 173.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -66.52 -39.34 88.6 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 11.6 mptt 71.23 117.75 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 124.417 1.087 . . . . 0.0 109.853 -173.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -124.39 170.63 10.64 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.73 0.812 . . . . 0.0 110.148 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.51 ' HG3' ' HG2' ' A' ' 83' ' ' LYS . 13.7 pt-20 -64.29 -41.34 96.93 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.369 173.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.51 ' HG2' ' HG3' ' A' ' 82' ' ' GLU . 17.3 ptpt -142.27 157.64 44.6 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.318 0.647 . . . . 0.0 109.554 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -67.7 -21.99 65.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.64 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -60.13 -43.98 95.27 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.495 0.318 . . . . 0.0 110.76 171.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.2 m -66.07 -29.28 69.59 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.178 0.591 . . . . 0.0 111.449 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 65.3 t -71.37 -49.18 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.013 0.925 . . . . 0.0 110.272 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 96.0 t -74.34 -33.01 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.838 1.255 . . . . 0.0 109.92 -174.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.85 89.02 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.802 173.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -73.96 -35.35 64.51 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.272 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.612 ' HE3' HD13 ' A' ' 76' ' ' ILE . 85.0 tttt -70.88 -46.7 62.14 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.44 1.096 . . . . 0.0 111.213 -169.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -20.75 66.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.684 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.2 mmtm -99.03 -47.62 5.17 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.117 0.567 . . . . 0.0 111.006 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.2 t -84.84 -20.25 31.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.018 0.927 . . . . 0.0 111.761 -170.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 122.975 0.51 . . . . 0.0 110.258 -176.244 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.73 101.92 3.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -99.48 115.03 28.35 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.468 HG23 ' HB3' ' A' ' 20' ' ' ALA . 31.6 mm -119.36 134.18 63.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -170.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.8 t -57.69 -51.43 69.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.264 1.025 . . . . 0.0 110.711 172.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 166.14 -54.08 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 125.758 1.623 . . . . 0.0 109.367 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -137.46 -51.3 0.63 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.308 -169.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -90.78 61.39 4.74 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.112 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.468 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -153.94 128.64 9.38 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.02 169.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HB2' ' H ' ' A' ' 22' ' ' ALA . 44.4 mtp180 -69.79 -79.45 0.06 Allowed 'General case' 0 CA--C 1.55 0.942 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 169.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.411 ' H ' ' HB2' ' A' ' 21' ' ' ARG . . . -164.72 140.63 5.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.204 1.002 . . . . 0.0 108.613 163.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.25 145.12 43.39 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.678 0.791 . . . . 0.0 109.044 175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -78.78 -9.36 59.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.857 0.463 . . . . 0.0 112.035 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -147.06 147.13 30.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.299 0.64 . . . . 0.0 110.77 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.4 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 22.6 t -62.09 -34.34 76.12 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.01 0.924 . . . . 0.0 111.844 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -73.25 -33.89 65.54 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 120.803 0.335 . . . . 0.0 110.36 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.79 -42.9 94.42 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.555 0.742 . . . . 0.0 111.127 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 26' ' ' SER . 0.3 OUTLIER -66.0 -34.46 78.14 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.969 175.105 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.18 -27.8 68.67 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 112.324 176.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.466 HG13 HG21 ' A' ' 50' ' ' THR . 79.1 t -63.02 -48.88 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.245 0.618 . . . . 0.0 110.976 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -62.56 -35.09 78.37 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.673 0.789 . . . . 0.0 109.943 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -66.22 4.34 0.72 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.975 1.31 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -46.79 -15.21 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 125.519 1.528 . . . . 0.0 114.622 170.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -49.88 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.638 0 C-N-CA 125.346 1.458 . . . . 0.0 110.212 173.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.0 -10.43 20.55 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -169.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.4 t -72.68 -42.05 64.68 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -161.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.12 -29.85 3.06 Favored Glycine 0 CA--C 1.541 1.693 0 CA-C-O 120.401 -0.11 . . . . 0.0 112.986 -165.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -107.79 77.78 1.15 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 125.174 1.389 . . . . 0.0 108.027 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -49.14 133.1 16.07 Favored Pre-proline 0 N--CA 1.491 1.58 0 C-N-CA 123.925 0.89 . . . . 0.0 112.06 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -70.88 -178.63 2.87 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.709 2.273 . . . . 0.0 111.516 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.411 HD11 ' N ' ' A' ' 42' ' ' LEU . 3.8 mp -102.03 90.04 3.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -170.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -121.65 142.92 49.66 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.532 0.733 . . . . 0.0 110.177 -172.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.516 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 40.8 t -69.85 108.1 3.83 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.527 1.131 . . . . 0.0 109.746 174.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.55 48.41 1.3 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 122.84 1.305 . . . . 0.0 108.492 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.516 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -126.53 -9.92 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 125.748 1.619 . . . . 0.0 108.049 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 5.8 p 179.61 -123.5 0.0 OUTLIER 'General case' 0 C--N 1.348 0.543 0 N-CA-C 102.758 -3.053 . . . . 0.0 102.758 -162.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.571 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.82 143.81 11.23 Favored Glycine 0 C--N 1.308 -1.001 0 CA-C-O 117.342 -1.81 . . . . 0.0 108.978 159.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.4 t80 177.38 112.36 0.03 OUTLIER 'General case' 0 C--N 1.361 1.093 0 N-CA-C 103.052 -2.944 . . . . 0.0 103.052 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.466 HG21 HG13 ' A' ' 31' ' ' VAL . 2.7 m -119.19 148.19 43.38 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 118.712 0.687 . . . . 0.0 109.733 -171.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 87.8 m -152.21 169.06 23.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.509 1.124 . . . . 0.0 110.256 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.1 ttt180 -84.41 -36.42 22.42 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.503 0.721 . . . . 0.0 110.002 170.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -92.67 130.13 38.39 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.462 0.705 . . . . 0.0 109.306 -173.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -61.63 -41.44 97.49 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.659 0.784 . . . . 0.0 110.399 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -43.18 65.9 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.72 0.808 . . . . 0.0 112.276 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.0 m -51.94 -53.41 41.44 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.705 0.802 . . . . 0.0 112.434 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.454 ' H ' HD22 ' A' ' 57' ' ' LEU . 1.3 pt? -77.14 -28.55 54.3 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.745 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -61.75 -30.91 71.09 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 118.495 0.588 . . . . 0.0 112.18 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -79.82 -49.47 11.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -49.29 -36.82 21.91 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.4 ' SD ' ' N ' ' A' ' 62' ' ' LYS . 3.6 ppp? -71.02 -35.44 72.02 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.509 1.05 . . . . 0.0 110.309 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.4 ' N ' ' SD ' ' A' ' 61' ' ' MET . 30.1 ttmt -67.06 -28.33 68.11 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.54 0.736 . . . . 0.0 111.462 172.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -61.98 -32.23 72.65 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.091 0.556 . . . . 0.0 112.021 170.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 . . . . . 0 N--CA 1.496 1.859 0 C-N-CA 122.699 0.4 . . . . 0.0 111.558 170.562 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 73.0 p . . . . . 0 C--O 1.239 0.513 0 CA-C-O 120.912 0.387 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.538 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 43.9 t -95.77 116.24 28.6 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -60.96 -15.72 34.65 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 122.062 -0.399 . . . . 0.0 111.578 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 mt -97.2 -37.6 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.23 0.612 . . . . 0.0 109.818 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 77' ' ' CYS . 14.1 p -160.05 56.85 0.36 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 121.019 0.438 . . . . 0.0 110.893 -178.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.538 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -25.48 74.26 0.0 OUTLIER Glycine 0 N--CA 1.492 2.392 0 C-N-CA 127.205 2.336 . . . . 0.0 118.265 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -88.46 -8.76 54.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.061 0.944 . . . . 0.0 111.682 171.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? 68.83 107.15 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.564 1.146 . . . . 0.0 110.298 173.691 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -110.59 168.05 9.76 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.044 0.538 . . . . 0.0 111.643 -172.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -59.66 -28.41 67.23 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.071 0.948 . . . . 0.0 112.297 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -163.66 161.72 23.79 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.351 0.661 . . . . 0.0 110.302 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 88' ' ' VAL . 25.0 pttm -65.8 -27.71 68.47 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.175 177.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -58.87 -39.68 82.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.575 0.75 . . . . 0.0 111.354 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.4 m -67.39 -31.72 72.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.234 0.613 . . . . 0.0 111.046 174.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.03 -40.91 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.732 0.813 . . . . 0.0 110.347 -177.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 84' ' ' LYS . 58.4 t -73.13 -36.16 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.293 1.037 . . . . 0.0 109.225 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . 0.481 ' O ' ' HG2' ' A' ' 93' ' ' LYS . . . -65.63 -40.68 92.81 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.418 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -71.82 -33.93 68.91 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.633 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -70.37 -33.5 71.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.136 0.974 . . . . 0.0 108.77 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.79 74.33 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.18 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 29.2 mmtp -93.95 -48.49 6.23 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.962 0.41 . . . . 0.0 111.092 -172.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -90.34 -23.74 21.04 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.68 0.792 . . . . 0.0 111.239 -171.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 . . . . . 0 CA--C 1.572 1.796 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.447 -173.779 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.86 90.04 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.484 1.113 . . . . 0.0 111.692 172.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -77.91 121.77 24.6 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.599 -176.793 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.6 mm -112.81 117.18 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.139 -171.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.409 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 46.6 t -57.7 -23.65 52.78 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.527 1.131 . . . . 0.0 111.572 172.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 115.93 -24.84 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.53 0 C-N-CA 127.287 2.235 . . . . 0.0 111.18 164.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -133.81 -48.65 0.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.809 0.814 . . . . 0.0 109.091 -177.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.1 p -114.92 64.02 0.68 Allowed 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.209 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.409 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -162.98 112.86 1.38 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.176 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.45 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 7.3 ptm180 -68.29 -45.17 73.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 169.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.45 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -172.58 148.97 2.03 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 123.772 0.829 . . . . 0.0 110.971 157.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -118.1 148.04 42.69 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -65.65 -25.54 67.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.4 m -147.02 156.93 43.42 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.964 0.411 . . . . 0.0 111.827 -175.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.3 p -59.11 -37.24 76.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.537 170.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.402 ' O ' HG22 ' A' ' 31' ' ' VAL . 15.2 m-70 -69.37 -39.26 78.14 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.867 0.867 . . . . 0.0 109.95 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -60.21 -51.06 71.19 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.52 1.128 . . . . 0.0 110.623 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -33.54 75.94 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.86 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.96 69.91 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.962 0.905 . . . . 0.0 112.207 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.524 HG21 ' HE ' ' A' ' 52' ' ' ARG . 25.8 t -68.32 -40.21 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.433 0.458 . . . . 0.0 110.338 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.82 -39.27 69.92 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.542 0.737 . . . . 0.0 109.69 175.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -64.08 -6.47 6.48 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.22 1.408 . . . . 0.0 111.614 -176.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.517 ' SD ' ' HB ' ' A' ' 50' ' ' THR . 25.9 ptt? -46.94 -15.19 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -54.4 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 125.226 1.41 . . . . 0.0 109.406 176.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.96 5.12 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 123.799 0.84 . . . . 0.0 112.98 -175.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -62.39 -35.78 80.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.747 0.419 . . . . 0.0 112.085 -168.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.57 -25.24 3.96 Favored Glycine 0 C--N 1.35 1.33 0 O-C-N 123.019 0.199 . . . . 0.0 112.719 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -128.47 89.22 2.86 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -53.56 112.73 3.97 Favored Pre-proline 0 N--CA 1.49 1.554 0 C-N-CA 123.946 0.898 . . . . 0.0 110.651 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.02 -67.35 0.04 OUTLIER 'Trans proline' 0 C--N 1.385 2.459 0 C-N-CA 122.682 2.255 . . . . 0.0 112.124 -173.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.456 ' HB3' HD21 ' A' ' 57' ' ' LEU . 85.4 mt -145.67 96.52 2.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.395 1.078 . . . . 0.0 108.458 -176.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -132.52 143.06 49.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.372 0.669 . . . . 0.0 110.545 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.4 t -63.91 110.53 2.13 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.335 1.054 . . . . 0.0 110.311 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -84.92 29.73 0.62 Allowed 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 123.845 0.858 . . . . 0.0 111.487 -178.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.35 -56.49 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.497 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.7 p -113.71 -117.67 0.32 Allowed 'General case' 0 C--O 1.239 0.507 0 N-CA-C 102.447 -3.168 . . . . 0.0 102.447 166.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.497 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.96 163.74 28.29 Favored Glycine 0 C--N 1.313 -0.696 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 156.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.6 t80 172.33 112.55 0.01 OUTLIER 'General case' 0 C--O 1.24 0.566 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.517 ' HB ' ' SD ' ' A' ' 34' ' ' MET . 3.4 m -114.3 138.05 51.01 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -173.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -144.97 162.06 37.84 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.761 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.524 ' HE ' HG21 ' A' ' 31' ' ' VAL . 38.0 ttm180 -76.98 -31.61 56.65 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.575 175.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.453 HE21 ' HB2' ' A' ' 55' ' ' ALA . 53.5 tt0 -106.71 122.16 45.8 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.701 0.8 . . . . 0.0 109.685 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -49.43 -47.59 47.98 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.63 1.172 . . . . 0.0 111.974 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.453 ' HB2' HE21 ' A' ' 53' ' ' GLN . . . -53.44 -31.85 47.21 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -63.43 -56.04 19.4 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.676 0.39 . . . . 0.0 111.371 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -75.06 -30.72 61.07 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.958 0.503 . . . . 0.0 111.646 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.02 -48.58 64.43 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.606 1.162 . . . . 0.0 112.776 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.442 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 8.8 m95 -77.06 -42.41 38.47 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.438 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 59.6 t60 -46.42 -41.36 13.63 Favored 'General case' 0 CA--C 1.569 1.678 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 168.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.501 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 75.0 mtm -71.41 -43.15 67.31 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 118.217 0.462 . . . . 0.0 111.562 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -60.31 -25.36 65.72 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 123.025 0.53 . . . . 0.0 111.855 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 32.6 mmmt -62.4 -38.59 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.924 0.49 . . . . 0.0 110.559 171.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.501 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 98.6 m-70 . . . . . 0 N--CA 1.496 1.856 0 C-N-CA 123.051 0.54 . . . . 0.0 111.085 172.154 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.233 0.219 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.557 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 0.9 OUTLIER -72.16 135.56 46.2 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 167.062 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.5 -27.07 65.82 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.975 0.91 . . . . 0.0 113.409 -174.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -113.08 -38.55 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 122.919 0.487 . . . . 0.0 110.308 -170.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.9 p -150.37 64.37 0.95 Allowed 'General case' 0 C--N 1.353 0.759 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -177.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.557 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -35.98 77.86 0.0 OUTLIER Glycine 0 C--N 1.355 1.627 0 C-N-CA 125.13 1.347 . . . . 0.0 116.407 167.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -68.41 -28.75 67.36 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.127 0.971 . . . . 0.0 110.989 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? 74.52 111.37 0.07 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 124.924 1.29 . . . . 0.0 110.387 -174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -116.6 155.82 28.06 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.17 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -29.97 66.29 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -135.4 150.96 50.02 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 122.82 0.448 . . . . 0.0 109.859 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -60.73 -30.4 69.96 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.977 0.911 . . . . 0.0 111.052 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -53.16 -45.8 68.63 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.828 0.705 . . . . 0.0 110.874 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.0 m -68.03 -30.46 69.7 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 t -74.56 -46.42 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.203 0.601 . . . . 0.0 110.024 -176.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -73.32 -37.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.664 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.65 -40.73 92.8 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 124.221 0.951 . . . . 0.0 109.354 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.99 -37.72 78.9 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.322 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -70.8 -41.19 71.94 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.804 0.841 . . . . 0.0 109.835 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.98 -28.72 68.49 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.273 0.629 . . . . 0.0 111.301 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -82.13 -53.53 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.539 1.136 . . . . 0.0 110.965 -174.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.03 -15.57 16.73 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.213 -166.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 . . . . . 0 CA--C 1.57 1.747 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -173.213 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . 0.508 HH11 ' HA ' ' A' ' 24' ' ' LYS . 34.4 ttp85 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -141.13 97.38 3.16 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -169.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.466 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 81.7 m-85 -91.55 108.03 19.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.164 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.1 mm -109.15 149.74 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.576 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 25.4 t -94.01 -23.86 17.86 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 0.0 110.505 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 113.97 -27.18 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 128.533 2.733 . . . . 0.0 111.024 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -135.88 -51.66 0.73 Allowed 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.652 0.739 . . . . 0.0 109.927 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 p -113.34 57.27 0.68 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.833 -172.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.576 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -159.91 116.12 2.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.962 0.905 . . . . 0.0 109.578 165.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -68.34 -48.92 63.55 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.07 164.28 9.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.368 1.067 . . . . 0.0 109.627 160.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 14' ' ' TYR . 88.5 m-85 -131.27 143.54 50.63 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.516 0.726 . . . . 0.0 109.815 167.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.508 ' HA ' HH11 ' A' ' 12' ' ' ARG . 25.9 ttpp -74.81 -24.83 58.69 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.071 0.948 . . . . 0.0 110.791 173.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -139.85 140.2 36.49 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.692 0.797 . . . . 0.0 110.336 -171.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.8 t -67.78 -25.88 65.83 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.234 172.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -70.44 -38.19 74.47 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.816 0.446 . . . . 0.0 110.799 174.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.66 -44.79 85.24 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 122.136 0.97 . . . . 0.0 109.617 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.64 -37.35 81.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.661 -1.609 . . . . 0.0 110.999 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.68 74.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.644 0.777 . . . . 0.0 112.23 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.677 HG12 ' HB ' ' A' ' 50' ' ' THR . 87.3 t -62.94 -44.74 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.649 0.78 . . . . 0.0 110.468 176.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -69.27 -38.02 78.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.84 0.856 . . . . 0.0 110.732 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.534 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 37.3 ttp180 -70.04 0.74 5.51 Favored 'General case' 0 C--O 1.21 -0.986 0 C-N-CA 124.319 1.047 . . . . 0.0 111.743 -172.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -46.43 -17.56 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 124.895 1.278 . . . . 0.0 114.319 172.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -54.17 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 124.427 1.091 . . . . 0.0 109.449 174.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -96.39 7.98 45.15 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.887 0.875 . . . . 0.0 111.658 -170.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 3.6 t -56.3 -64.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -156.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.6 35.69 75.02 Favored Glycine 0 N--CA 1.474 1.188 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.414 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 38.4 mt-10 -146.1 -38.01 0.24 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.567 1.547 . . . . 0.0 108.122 -169.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt 72.16 78.21 0.2 Allowed Pre-proline 0 C--N 1.358 0.95 0 C-N-CA 125.483 1.513 . . . . 0.0 109.9 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.43 170.01 19.09 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 122.82 2.347 . . . . 0.0 111.384 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.7 mt -111.48 140.62 45.92 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.674 0.79 . . . . 0.0 109.757 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 143.66 50.99 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -173.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.0 t -63.56 106.52 0.96 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.43 -29.18 33.98 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.909 1.283 . . . . 0.0 112.027 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.6 mm -74.29 -47.9 38.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 123.17 0.588 . . . . 0.0 109.985 -176.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.0 p -142.96 -89.36 0.13 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 120.586 0.231 . . . . 0.0 111.109 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.602 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -156.23 132.81 3.44 Favored Glycine 0 C--N 1.339 0.75 0 CA-C-O 116.838 -2.09 . . . . 0.0 109.709 -170.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.1 t80 168.1 112.91 0.01 OUTLIER 'General case' 0 C--N 1.353 0.752 0 N-CA-C 103.065 -2.939 . . . . 0.0 103.065 170.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.677 ' HB ' HG12 ' A' ' 31' ' ' VAL . 2.9 m -113.63 134.98 54.41 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -175.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 4.8 p -159.62 159.16 32.82 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 124.089 0.868 . . . . 0.0 110.891 176.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.46 -10.68 59.44 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.319 1.048 . . . . 0.0 111.252 176.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -103.01 109.31 20.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.392 1.077 . . . . 0.0 108.994 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -52.06 -42.47 63.17 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.467 0.707 . . . . 0.0 111.712 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.89 -41.73 64.63 Favored 'General case' 0 CA--C 1.556 1.186 0 O-C-N 124.698 1.249 . . . . 0.0 111.999 177.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.597 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 20.0 t -61.19 -52.63 64.01 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.643 0.777 . . . . 0.0 111.653 -173.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.25 -33.42 63.32 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.315 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -52.35 -42.29 63.77 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.826 0.851 . . . . 0.0 112.637 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -80.14 -38.49 31.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -177.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.8 t60 -48.26 -34.19 9.93 Favored 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 162.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.41 -35.14 70.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 172.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -61.03 -27.41 68.31 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 167.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -68.98 -31.15 69.79 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.845 0.458 . . . . 0.0 110.243 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 123.41 0.684 . . . . 0.0 111.261 173.282 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 61.0 p . . . . . 0 CA--C 1.526 0.046 0 CA-C-O 121.302 0.572 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.0 t -76.35 126.5 31.11 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.046 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.45 -27.83 69.38 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.526 0.603 . . . . 0.0 111.462 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mt -88.24 -44.08 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.968 -170.785 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -131.69 -2.73 3.74 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 119.231 0.923 . . . . 0.0 112.335 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.17 31.72 56.51 Favored Glycine 0 C--N 1.362 2.001 0 N-CA-C 115.004 0.762 . . . . 0.0 115.004 174.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -62.61 -23.4 67.03 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm 77.8 118.62 0.06 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.826 1.25 . . . . 0.0 111.228 175.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -125.7 162.57 24.73 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.69 0.796 . . . . 0.0 111.832 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -72.3 -32.5 66.65 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.856 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -150.14 165.34 33.13 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-O 121.014 0.435 . . . . 0.0 111.395 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -56.13 -40.66 74.11 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.931 1.293 . . . . 0.0 111.528 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.87 -41.97 68.1 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.045 0.841 . . . . 0.0 111.503 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.0 m -66.13 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.647 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.9 t -76.3 -42.9 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 C-N-CA 123.728 0.811 . . . . 0.0 110.11 -174.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.7 -41.39 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.301 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.74 -36.58 80.83 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 113.966 -1.47 . . . . 0.0 109.742 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -68.25 -45.15 73.99 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.572 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 ttpt -70.16 -40.26 74.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.693 0.797 . . . . 0.0 109.715 -167.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.3 -30.38 66.6 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.061 177.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -102.76 -40.64 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.46 0.704 . . . . 0.0 111.742 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.2 t -85.95 -17.78 34.45 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.611 1.165 . . . . 0.0 111.158 -170.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 . . . . . 0 CA--C 1.567 1.629 0 C-N-CA 123.006 0.522 . . . . 0.0 111.043 -176.498 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? . . . . . 0 N--CA 1.496 1.859 0 CA-C-O 121.398 0.618 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -128.14 94.23 3.86 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.196 0.998 . . . . 0.0 108.817 -167.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.3 118.77 20.11 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 126.111 1.764 . . . . 0.0 109.077 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.513 HG23 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -114.64 151.13 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -173.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.595 ' H ' ' HB2' ' A' ' 20' ' ' ALA . 2.2 t -81.61 -23.53 36.97 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.712 0.805 . . . . 0.0 111.281 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.513 ' H ' HG23 ' A' ' 15' ' ' ILE . 36.1 tt0 85.87 -5.46 0.82 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.491 1.516 . . . . 0.0 110.288 174.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -134.76 -51.01 0.78 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.447 0.699 . . . . 0.0 109.311 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -144.27 79.37 1.61 Allowed 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.003 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.595 ' HB2' ' H ' ' A' ' 16' ' ' CYS . . . -163.24 129.29 3.25 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.748 1.219 . . . . 0.0 109.293 164.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.524 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 35.3 ptt180 -66.61 -59.68 3.39 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.184 0.927 . . . . 0.0 108.731 175.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.524 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -176.22 146.45 0.66 Allowed 'General case' 0 C--N 1.354 0.777 0 C-N-CA 124.941 1.296 . . . . 0.0 108.519 169.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -119.34 139.13 52.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 173.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -89.42 0.38 56.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.313 0.245 . . . . 0.0 110.863 174.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 m -137.75 133.01 33.61 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.282 0.633 . . . . 0.0 110.052 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.8 p -61.79 -38.5 88.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.382 1.073 . . . . 0.0 111.526 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.476 ' O ' HG21 ' A' ' 31' ' ' VAL . 51.7 m-70 -62.48 -40.17 95.8 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.993 0.517 . . . . 0.0 111.47 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.79 -45.11 95.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.718 0.807 . . . . 0.0 110.175 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.42 -40.96 98.26 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.957 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.05 -30.32 71.27 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.227 0.611 . . . . 0.0 111.896 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 27' ' ' HIS . 81.2 t -65.98 -41.54 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.46 0.704 . . . . 0.0 110.465 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -68.44 -40.39 81.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.559 0.744 . . . . 0.0 110.83 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -65.09 -3.34 3.57 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.928 1.291 . . . . 0.0 112.128 -175.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -45.16 -24.41 0.25 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 125.193 1.397 . . . . 0.0 114.115 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.6 tp -87.2 -40.47 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 C-N-CA 124.323 1.049 . . . . 0.0 110.598 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -98.57 -19.04 17.82 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -172.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -62.03 -49.06 77.51 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -158.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.97 -31.1 3.75 Favored Glycine 0 C--N 1.338 0.665 0 CA-C-O 120.06 -0.3 . . . . 0.0 112.68 -164.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -111.17 78.85 1.15 Allowed 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 172.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -58.12 121.89 54.48 Favored Pre-proline 0 N--CA 1.478 0.957 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.099 -174.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -63.47 -86.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.741 2.294 . . . . 0.0 111.981 -172.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -145.55 100.65 3.47 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -142.18 126.95 18.11 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.371 0.668 . . . . 0.0 109.743 -176.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 t -64.67 109.4 2.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.872 1.269 . . . . 0.0 111.27 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -87.6 49.26 1.77 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.759 1.224 . . . . 0.0 110.085 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mm -133.9 -3.47 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.606 0 C-N-CA 125.528 1.531 . . . . 0.0 108.004 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.2 p 179.66 -133.44 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 102.745 -3.058 . . . . 0.0 102.745 -165.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.486 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.68 129.55 3.24 Favored Glycine 0 C--N 1.306 -1.117 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 161.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -176.79 113.29 0.1 Allowed 'General case' 0 C--N 1.354 0.803 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 -170.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 m -115.55 140.68 48.94 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 63.0 m -133.01 161.58 33.99 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.555 1.142 . . . . 0.0 110.875 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -97.24 -31.88 12.2 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.148 0.979 . . . . 0.0 109.462 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -97.28 130.71 44.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.152 0.981 . . . . 0.0 110.227 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -57.73 -44.03 85.7 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.57 1.148 . . . . 0.0 111.416 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.73 -40.56 69.39 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.591 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 t -56.92 -55.43 34.6 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.738 0.815 . . . . 0.0 112.302 -175.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 2.2 pt? -75.83 -27.94 58.07 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 119.332 -0.366 . . . . 0.0 111.673 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.451 ' O ' ' HG3' ' A' ' 61' ' ' MET . 6.3 t30 -58.92 -39.82 82.7 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.787 0.835 . . . . 0.0 112.744 175.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -79.69 -45.94 18.04 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 68.7 t60 -48.21 -37.73 16.61 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 168.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -72.09 -35.22 69.15 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 119.647 1.112 . . . . 0.0 110.759 178.105 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.45 -31.4 72.11 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.058 0.543 . . . . 0.0 111.277 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HB3' ' HZ3' ' A' ' 63' ' ' LYS . 3.8 mmmp? -58.54 -30.32 67.01 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.933 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 96.8 m-70 . . . . . 0 N--CA 1.49 1.549 0 C-N-CA 123.064 0.546 . . . . 0.0 111.798 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 77.2 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 121.541 0.686 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.649 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 5.1 t -100.32 124.18 45.47 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 170.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -70.56 -5.4 28.78 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.246 0.475 . . . . 0.0 111.739 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.5 -32.13 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.725 0.81 . . . . 0.0 109.15 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.4 p -170.32 70.59 0.06 Allowed 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . 0.649 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -39.46 76.5 0.0 OUTLIER Glycine 0 N--CA 1.48 1.567 0 N-CA-C 117.672 1.829 . . . . 0.0 117.672 175.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -66.68 -21.87 66.09 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.185 0.994 . . . . 0.0 111.264 171.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm 70.86 103.2 0.06 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.987 1.315 . . . . 0.0 109.628 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.407 ' HB3' ' HB3' ' A' ' 86' ' ' SER . 70.2 m-85 -107.41 160.53 15.57 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.297 0.639 . . . . 0.0 111.55 -167.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.51 -38.66 81.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.361 1.065 . . . . 0.0 112.629 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -166.66 172.73 10.32 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 123.831 0.707 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -55.6 -34.57 64.98 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.284 1.433 . . . . 0.0 112.578 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -54.86 -45.72 74.6 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 123.801 0.688 . . . . 0.0 111.182 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.407 ' HB3' ' HB3' ' A' ' 81' ' ' PHE . 26.3 t -69.81 -30.83 68.45 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.728 0.642 . . . . 0.0 111.107 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.7 t -73.31 -44.61 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 0.0 109.98 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.43 -38.07 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 113.731 -1.577 . . . . 0.0 109.169 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.19 -38.48 82.06 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.772 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -66.67 -49.69 65.34 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.448 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.592 ' HZ2' ' HB3' ' A' ' 91' ' ' LYS . 5.7 ttpm? -70.82 -39.3 73.11 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.031 0.532 . . . . 0.0 110.113 -168.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.96 -23.91 67.36 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.081 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -99.23 -44.49 6.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 123.332 0.395 . . . . 0.0 111.425 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.9 t -82.14 -26.73 33.25 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.457 1.103 . . . . 0.0 111.204 -173.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 . . . . . 0 CA--C 1.558 1.254 0 C-N-CA 122.707 0.403 . . . . 0.0 111.49 -175.199 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 . . . . . 0 N--CA 1.475 0.799 0 CA-C-O 121.672 0.749 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HB2' ' HB2' ' A' ' 22' ' ' ALA . 6.6 p-10 -149.68 98.86 2.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.035 -170.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -76.97 119.74 21.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.618 -1.628 . . . . 0.0 109.663 174.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -105.03 149.18 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.687 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 1.4 t -83.6 163.39 20.39 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.611 0.72 . . . . 0.0 110.283 176.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 31.5 tt0 -58.4 -32.76 68.93 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.523 -1.671 . . . . 0.0 111.217 -176.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -138.4 -49.52 0.55 Allowed 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.097 0.559 . . . . 0.0 109.978 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.2 p -124.84 72.18 1.21 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.605 -169.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.687 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -141.65 135.09 29.59 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.983 150.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -69.19 -58.94 3.39 Favored 'General case' 0 CA--C 1.555 1.145 0 O-C-N 124.241 0.963 . . . . 0.0 109.483 168.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.447 ' HB2' ' HB2' ' A' ' 13' ' ' ASP . . . -172.99 133.4 0.54 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 123.567 0.747 . . . . 0.0 111.083 170.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -114.35 130.75 56.69 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -80.29 3.73 20.02 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 118.44 0.564 . . . . 0.0 111.738 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' SER . . . . . 0.439 ' HB3' ' ND2' ' A' ' 28' ' ' ASN . 16.7 t -137.4 134.88 36.42 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.138 0.975 . . . . 0.0 109.827 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.4 p -69.14 -28.83 66.8 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.832 0.853 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.465 ' O ' HG21 ' A' ' 31' ' ' VAL . 67.9 t60 -62.97 -44.29 96.46 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.176 0.59 . . . . 0.0 110.252 176.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.444 ' ND2' HH12 ' A' ' 52' ' ' ARG . 3.3 m-80 -53.7 -51.28 63.78 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.119 0.968 . . . . 0.0 111.464 177.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.8 tp -67.7 -34.86 77.72 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.287 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.43 88.26 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.056 0.543 . . . . 0.0 111.004 176.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.665 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 61.8 t -65.17 -36.67 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.553 175.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -65.28 -40.98 94.58 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.026 0.93 . . . . 0.0 110.75 174.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.449 ' HG2' ' HB2' ' A' ' 36' ' ' HIS . 17.2 ttt180 -75.08 9.74 1.83 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 123.907 0.883 . . . . 0.0 111.505 -174.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.532 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 25.7 ptt? -49.68 -27.47 4.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.307 1.443 . . . . 0.0 113.705 169.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.8 tp -86.82 -29.15 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.225 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.449 ' HB2' ' HG2' ' A' ' 33' ' ' ARG . 58.0 m-70 -99.9 -60.24 1.57 Allowed 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -167.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -104.35 24.99 10.7 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -149.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.95 43.26 34.68 Favored Glycine 0 N--CA 1.478 1.497 0 C-N-CA 119.872 -1.156 . . . . 0.0 113.496 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.532 ' O ' ' HA ' ' A' ' 34' ' ' MET . 11.1 mm-40 -146.75 114.99 6.64 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 124.592 1.157 . . . . 0.0 108.229 -166.264 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -112.4 94.0 25.2 Favored Pre-proline 0 N--CA 1.472 0.665 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 167.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.665 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 28.3 Cg_endo -58.32 -67.21 0.06 OUTLIER 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 123.543 2.829 . . . . 0.0 112.188 -174.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.505 HD23 ' HB2' ' A' ' 54' ' ' LYS . 86.3 mt -146.23 90.88 2.0 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -136.48 135.6 38.72 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.794 0.437 . . . . 0.0 111.904 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 7.5 t -71.58 105.35 3.61 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.698 1.199 . . . . 0.0 109.725 171.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -93.27 49.49 1.41 Allowed 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.574 1.178 . . . . 0.0 110.185 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 3.1 mp -114.57 -55.31 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 169.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 21.3 p -112.7 -113.03 0.33 Allowed 'General case' 0 C--O 1.238 0.462 0 N-CA-C 103.997 -2.594 . . . . 0.0 103.997 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -148.32 154.63 25.98 Favored Glycine 0 C--N 1.313 -0.742 0 N-CA-C 108.626 -1.79 . . . . 0.0 108.626 152.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.498 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.9 t80 172.48 114.37 0.01 OUTLIER 'General case' 0 C--N 1.351 0.662 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -173.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.1 m -129.4 138.31 51.42 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 52' ' ' ARG . 52.0 t -136.36 167.13 21.91 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.131 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.444 HH12 ' ND2' ' A' ' 28' ' ' ASN . 16.8 tpp85 -70.44 -33.82 71.75 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.239 176.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -121.43 134.04 55.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.376 0.67 . . . . 0.0 109.918 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.505 ' HB2' HD23 ' A' ' 42' ' ' LEU . 5.5 ttpm? -59.29 -21.76 60.16 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.495 0.718 . . . . 0.0 111.374 174.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.98 -28.13 15.74 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.647 1.179 . . . . 0.0 112.582 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -77.52 -55.0 5.74 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.27 0.628 . . . . 0.0 112.358 175.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.559 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -75.86 -34.55 60.04 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -171.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . 0.45 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 1.3 p-10 -55.51 -37.48 67.95 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 45.8 p-90 -86.04 -35.85 20.07 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 118.251 0.478 . . . . 0.0 111.02 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.559 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 65.8 t60 -48.26 -32.23 6.98 Favored 'General case' 0 CA--C 1.572 1.822 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 171.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 58' ' ' ASN . 23.8 ptp -69.48 -32.19 70.94 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.935 -1.103 . . . . 0.0 112.35 170.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 39.3 ttmt -58.11 -29.17 65.28 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 122.921 0.488 . . . . 0.0 111.457 169.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 31.2 mmmt -63.61 -38.09 89.8 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.916 0.486 . . . . 0.0 110.61 175.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.438 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.3 m-70 . . . . . 0 N--CA 1.481 1.125 0 C-N-CA 123.116 0.567 . . . . 0.0 110.281 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.0 m . . . . . 0 C--O 1.235 0.317 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 9.8 t -87.19 105.63 17.33 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -58.74 -8.79 1.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.4 mt -93.9 -48.05 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 123.553 0.741 . . . . 0.0 112.156 178.089 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 15.9 p -132.06 5.39 4.17 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.35 34.83 59.79 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 123.563 0.601 . . . . 0.0 114.366 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 8.1 tmtm? -65.21 -28.86 69.66 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.063 0.545 . . . . 0.0 111.712 -174.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 71.08 116.62 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.658 1.183 . . . . 0.0 110.872 172.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.403 ' CZ ' ' HD2' ' A' ' 79' ' ' LYS . 89.5 m-85 -127.46 160.34 31.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.623 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.47 -40.14 95.14 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.91 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -136.59 154.59 50.64 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 123.277 0.631 . . . . 0.0 109.981 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -59.93 -31.19 69.62 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.347 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.55 -45.16 81.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.62 0.768 . . . . 0.0 110.714 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.5 m -67.87 -30.82 70.29 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 123.77 0.669 . . . . 0.0 111.776 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.29 -48.53 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 C-N-CA 123.431 0.692 . . . . 0.0 110.425 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.0 t -73.68 -35.07 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 109.657 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.36 95.42 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.282 173.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -72.81 -34.74 67.07 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.689 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -73.78 -36.81 65.1 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.316 0.647 . . . . 0.0 109.823 -176.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.38 -38.54 89.98 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.033 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -97.01 -46.85 6.03 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -169.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.3 t -80.28 -20.74 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.633 0.773 . . . . 0.0 110.673 -173.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 . . . . . 0 CA--C 1.561 1.399 0 C-N-CA 123.147 0.579 . . . . 0.0 109.532 -176.74 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -143.54 94.82 2.65 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.746 1.26 . . . . 0.0 108.786 -166.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -99.84 133.52 44.08 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 113.516 -1.675 . . . . 0.0 109.57 -174.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.593 HG23 ' H ' ' A' ' 17' ' ' GLU . 6.7 mm -115.18 149.49 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.603 0.761 . . . . 0.0 109.582 -166.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.572 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.8 t -85.49 -20.39 29.79 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.531 0.732 . . . . 0.0 109.979 174.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 15' ' ' ILE . 36.7 tt0 85.95 -3.97 0.79 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 126.235 1.814 . . . . 0.0 111.19 171.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -135.87 -49.2 0.69 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -136.21 77.14 1.64 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.357 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.572 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -170.85 128.04 0.75 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.605 1.162 . . . . 0.0 109.394 163.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.455 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 34.1 ptt180 -68.86 -58.25 4.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.455 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -173.2 152.85 2.34 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 124.135 0.974 . . . . 0.0 109.616 164.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -125.94 152.05 46.15 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.558 1.143 . . . . 0.0 108.29 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -59.03 -30.31 67.93 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 m -143.21 156.11 44.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.269 0.628 . . . . 0.0 110.98 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.546 ' HA ' HD23 ' A' ' 29' ' ' LEU . 41.9 m -57.11 -36.52 70.73 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.608 171.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -74.13 -35.41 64.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.087 0.555 . . . . 0.0 110.732 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.78 -47.21 86.59 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.405 0.682 . . . . 0.0 110.467 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.2 OUTLIER -66.98 -28.99 68.71 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.828 0.851 . . . . 0.0 110.747 174.232 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.71 -27.52 69.27 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.936 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.11 -41.45 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 122.749 0.42 . . . . 0.0 110.212 173.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -64.92 -38.45 91.01 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.703 0.801 . . . . 0.0 110.222 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.461 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 24.9 ttt85 -70.03 5.95 1.42 Allowed 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 124.859 1.263 . . . . 0.0 111.723 -176.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.0 ptm -46.11 -18.4 0.05 Allowed 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 125.314 1.446 . . . . 0.0 113.574 171.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.98 -52.88 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.919 0 C-N-CA 125.403 1.481 . . . . 0.0 110.428 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.461 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -100.42 6.45 44.42 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.535 0.734 . . . . 0.0 112.65 -172.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 t -58.88 -55.4 35.58 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -163.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.08 -31.41 3.13 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-O 120.083 -0.287 . . . . 0.0 112.62 -171.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -86.75 -48.54 8.16 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.883 0.873 . . . . 0.0 110.886 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.5 mttp 70.3 122.75 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 126.107 1.763 . . . . 0.0 111.429 -168.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.27 -170.84 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.217 0 C-N-CA 121.979 1.786 . . . . 0.0 110.679 164.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.438 HD12 ' HB3' ' A' ' 54' ' ' LYS . 95.4 mt -92.38 98.22 11.35 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -122.46 130.15 52.77 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.389 1.076 . . . . 0.0 110.134 -167.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.448 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 21.1 t -69.0 107.05 2.98 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.33 170.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.49 27.28 0.44 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.581 1.152 . . . . 0.0 111.693 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.448 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 21.8 mm -118.82 -3.31 9.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.479 1.112 . . . . 0.0 108.773 -168.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.4 p 179.93 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.523 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 -169.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.26 135.47 5.24 Favored Glycine 0 C--N 1.309 -0.918 0 N-CA-C 107.142 -2.383 . . . . 0.0 107.142 158.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -179.36 111.86 0.05 Allowed 'General case' 0 C--N 1.346 0.431 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.2 m -128.71 146.52 50.86 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -166.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 t -157.48 179.04 9.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.595 -177.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -110.52 -3.43 16.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.409 0.684 . . . . 0.0 110.149 169.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -106.02 104.64 14.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 172.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.438 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.5 pttt -57.64 -33.54 68.39 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.622 0.769 . . . . 0.0 112.801 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.41 -41.73 69.63 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.758 0.823 . . . . 0.0 112.097 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.3 m -52.08 -52.87 48.46 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.088 0.955 . . . . 0.0 112.616 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.85 -31.49 51.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.607 0.763 . . . . 0.0 111.995 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.69 -44.0 97.06 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.575 0.75 . . . . 0.0 112.968 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -81.03 -36.84 30.04 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -51.57 -30.72 21.88 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.456 1.102 . . . . 0.0 113.683 165.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.436 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 28.5 ttt -71.6 -39.57 70.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.102 0.561 . . . . 0.0 111.357 173.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -58.77 -34.43 71.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.273 0.629 . . . . 0.0 110.654 168.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -64.19 -29.42 70.53 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.628 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 82.7 m-70 . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.882 -0.511 . . . . 0.0 111.794 172.815 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.9 t -70.69 114.03 8.37 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 169.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -60.12 -13.89 14.24 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -172.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mt -104.38 -31.41 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -175.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.542 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 19.4 p -136.2 -4.95 2.11 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.765 -1.209 . . . . 0.0 113.389 -178.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.05 33.75 85.26 Favored Glycine 0 C--N 1.347 1.185 0 C-N-CA 123.039 0.352 . . . . 0.0 113.381 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.542 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.0 tmtt? -65.76 -35.13 79.85 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.03 0.932 . . . . 0.0 112.103 -176.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? 73.67 120.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.816 1.246 . . . . 0.0 110.4 -176.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -128.56 162.42 27.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.913 0.885 . . . . 0.0 109.861 175.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.472 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 8.1 mm-40 -70.69 -28.3 64.66 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.437 0.695 . . . . 0.0 112.673 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.472 ' HD3' ' HB2' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -144.39 151.22 38.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.122 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -66.2 -25.1 66.77 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.632 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.65 -28.29 65.76 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.412 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 49.4 m -67.48 -31.7 72.03 Favored 'General case' 0 C--N 1.359 1.012 0 O-C-N 122.952 0.157 . . . . 0.0 110.923 171.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.4 t -75.15 -47.69 34.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.002 0.921 . . . . 0.0 110.196 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 70.6 t -73.34 -35.94 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.081 1.352 . . . . 0.0 109.959 -174.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.89 95.33 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 86' ' ' SER . 2.3 t60 -71.41 -30.18 65.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.873 178.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.6 -41.0 69.47 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.412 1.085 . . . . 0.0 109.603 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.36 64.36 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.125 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . 0.527 ' HB3' ' HZ2' ' A' ' 93' ' ' LYS . 8.1 mtpm? -105.58 -42.03 5.31 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.219 0.608 . . . . 0.0 112.34 -176.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.8 t -93.26 -23.08 18.64 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.096 0.958 . . . . 0.0 111.306 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 . . . . . 0 CA--C 1.57 1.732 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.057 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.4 ttt-85 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 122.563 1.173 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -164.71 114.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -168.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -121.54 120.62 35.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.792 0.837 . . . . 0.0 110.715 -178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 43.0 mm -100.95 110.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.097 -177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.7 t -61.97 90.82 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 158.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 18.47 -59.44 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 129.101 2.96 . . . . 0.0 116.563 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -121.35 -39.28 2.69 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.474 -165.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.25 -23.36 19.35 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.32 125.88 35.3 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -170.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -52.01 29.77 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.029 163.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -177.43 138.17 0.22 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 125.24 1.416 . . . . 0.0 108.568 160.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -105.02 151.81 23.5 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -63.29 -34.71 78.27 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.309 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 m -146.95 154.44 41.27 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 121.124 0.488 . . . . 0.0 111.817 -169.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 p -61.03 -45.31 95.3 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.72 1.208 . . . . 0.0 112.142 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -68.78 -35.63 77.29 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.26 -51.69 67.2 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.505 0.722 . . . . 0.0 111.106 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -37.11 85.12 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.984 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.06 -29.23 68.41 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 124.137 0.898 . . . . 0.0 112.532 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.99 -45.21 95.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.219 0.608 . . . . 0.0 110.972 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -35.83 70.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.333 0.653 . . . . 0.0 109.479 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.65 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 39.1 ttt85 -61.96 -8.08 4.68 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.348 1.459 . . . . 0.0 112.361 -175.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.0 ptm -46.04 -12.55 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -53.42 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 C-N-CA 124.587 1.155 . . . . 0.0 108.641 172.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.547 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -101.82 14.37 32.14 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.399 1.479 . . . . 0.0 112.435 -176.161 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.65 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 13.5 t -57.89 -70.47 0.13 Allowed 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -154.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.03 32.86 81.8 Favored Glycine 0 N--CA 1.479 1.541 0 CA-C-N 118.994 0.815 . . . . 0.0 111.099 -169.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.441 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 10.6 mm-40 -147.5 -42.31 0.17 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.517 1.927 . . . . 0.0 106.913 -172.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? 61.5 96.67 0.04 OUTLIER Pre-proline 0 C--N 1.356 0.878 0 C-N-CA 126.067 1.747 . . . . 0.0 112.245 174.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.07 -173.23 1.6 Allowed 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.4 2.067 . . . . 0.0 110.185 161.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -120.3 118.47 30.49 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.802 0.441 . . . . 0.0 110.064 -175.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -116.06 148.78 39.85 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.577 0.751 . . . . 0.0 109.664 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.461 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.8 t -66.37 107.74 2.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.475 0.71 . . . . 0.0 109.962 167.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -75.91 8.71 2.89 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.646 0.779 . . . . 0.0 112.893 -178.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.461 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 39.2 mm -88.77 -56.24 5.44 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.504 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.3 p -119.44 -107.76 0.37 Allowed 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 104.139 -2.541 . . . . 0.0 104.139 175.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.504 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.16 164.18 29.24 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 160.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.0 t80 167.47 112.61 0.01 OUTLIER 'General case' 0 C--N 1.353 0.725 0 N-CA-C 103.379 -2.822 . . . . 0.0 103.379 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m -117.1 135.31 53.84 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.577 0.703 . . . . 0.0 109.765 -165.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.4 t -151.89 164.4 37.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.837 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -81.57 -31.14 32.74 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.069 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -103.99 127.18 51.54 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.372 1.069 . . . . 0.0 109.487 -173.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -55.86 -30.21 61.14 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.723 0.639 . . . . 0.0 112.029 175.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.52 83.44 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.397 1.079 . . . . 0.0 112.901 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -59.97 -54.36 46.94 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.343 0.657 . . . . 0.0 111.674 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.5 OUTLIER -75.43 -24.11 57.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 123.744 0.818 . . . . 0.0 112.013 177.605 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -52.0 -42.98 63.43 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.553 0.741 . . . . 0.0 112.751 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -79.67 -48.37 13.81 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 83.2 t60 -48.52 -39.98 25.2 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.417 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 0.0 OUTLIER -71.01 -37.53 72.63 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 119.991 1.268 . . . . 0.0 110.551 175.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -65.24 -26.35 68.07 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.532 0.733 . . . . 0.0 111.496 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -35.54 79.44 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.417 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 94.6 m-70 . . . . . 0 N--CA 1.485 1.311 0 C-N-CA 123.136 0.574 . . . . 0.0 111.659 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.528 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 68.8 p . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 37.2 t -123.6 97.31 5.32 Favored 'General case' 0 C--O 1.2 -1.534 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -56.72 -14.83 3.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -169.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 mt -87.35 -22.87 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.749 0.419 . . . . 0.0 111.474 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.654 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.4 p -147.56 4.14 0.77 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 53.09 37.02 53.45 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.161 0.886 . . . . 0.0 114.72 -177.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.654 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.1 tmtt? -66.3 -37.91 86.5 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 111.646 -172.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 71.5 mmtt 72.25 117.02 0.05 OUTLIER 'General case' 0 C--N 1.362 1.15 0 C-N-CA 124.797 1.239 . . . . 0.0 110.11 176.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.402 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.6 m-85 -125.31 164.99 19.17 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.57 -39.51 94.57 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 114.408 -1.269 . . . . 0.0 111.54 176.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -145.8 155.83 43.18 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.021 0.528 . . . . 0.0 110.023 -177.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.9 pptp? -64.34 -24.42 67.64 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.102 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.52 -47.1 80.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.062 0.545 . . . . 0.0 110.484 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -65.81 -30.77 71.45 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.423 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 86.5 t -72.92 -49.26 40.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.714 0.805 . . . . 0.0 110.194 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.78 -35.37 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.963 1.305 . . . . 0.0 109.182 -174.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.52 -44.41 94.32 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.517 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.05 -35.0 66.62 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.42 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -69.83 -38.81 76.65 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.277 1.031 . . . . 0.0 109.244 -172.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.24 -23.07 66.35 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.459 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -91.94 -50.82 5.51 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 121.197 0.522 . . . . 0.0 110.423 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.7 t -85.12 -23.92 28.24 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.825 1.25 . . . . 0.0 111.795 -169.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.7 m-70 . . . . . 0 CA--C 1.562 1.439 0 C-N-CA 122.557 0.343 . . . . 0.0 111.715 -172.779 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 59.85 95.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.117 1.367 . . . . 0.0 111.707 -177.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.27 113.11 24.69 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -177.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.4 mm -105.54 157.05 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.22 0.608 . . . . 0.0 109.576 -167.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.571 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 23.4 t -90.85 12.21 20.12 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.679 0.391 . . . . 0.0 111.205 173.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 87.54 -38.88 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.761 1.624 . . . . 0.0 110.08 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -137.41 -55.26 0.69 Allowed 'General case' 0 C--N 1.351 0.664 0 C-N-CA 122.73 0.412 . . . . 0.0 110.028 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 p -94.82 58.86 2.31 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.571 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -166.14 142.24 4.94 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.003 0.921 . . . . 0.0 110.46 160.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 10.2 ptp180 -68.0 -58.55 4.34 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 118.982 -0.532 . . . . 0.0 109.621 167.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.411 ' N ' ' HG3' ' A' ' 21' ' ' ARG . . . 174.28 134.87 0.04 OUTLIER 'General case' 0 C--N 1.358 0.961 0 C-N-CA 125.738 1.615 . . . . 0.0 108.0 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -108.46 164.52 12.27 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -56.4 -44.53 80.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.934 1.294 . . . . 0.0 111.339 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.0 m -146.21 168.59 20.65 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.301 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.512 ' HA ' HD23 ' A' ' 29' ' ' LEU . 51.0 p -64.62 -39.24 93.37 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.275 1.03 . . . . 0.0 112.617 -176.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -75.13 -37.0 61.57 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.395 0.678 . . . . 0.0 110.909 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.49 -41.93 73.71 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.911 0.885 . . . . 0.0 110.581 167.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.512 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -72.8 -33.81 66.48 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.899 178.236 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.607 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -62.75 -28.23 69.83 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.336 1.055 . . . . 0.0 111.9 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.2 t -50.29 -46.65 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 123.834 0.709 . . . . 0.0 111.49 168.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -77.06 -45.66 26.34 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.349 171.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.607 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 56.8 ttt180 -79.04 40.21 0.4 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.289 1.435 . . . . 0.0 110.155 -170.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -60.7 -52.77 63.69 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 123.824 0.85 . . . . 0.0 112.405 -162.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.2 tp -85.16 -17.89 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 49.3 m-70 -84.33 -42.3 15.91 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 120.613 1.552 . . . . 0.0 109.734 -156.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.3 t -70.9 -27.36 63.74 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 114.768 -1.106 . . . . 0.0 113.405 -165.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.58 33.88 12.69 Favored Glycine 0 C--N 1.342 0.874 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.183 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -110.83 -30.56 7.5 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.285 1.034 . . . . 0.0 109.98 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.9 pttt 44.55 72.84 1.09 Allowed Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 126.323 1.849 . . . . 0.0 112.572 -171.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.72 147.41 94.75 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.508 2.139 . . . . 0.0 111.581 175.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 50' ' ' THR . 91.2 mt -80.64 137.12 36.32 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -171.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.459 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 61.7 tt0 -117.65 139.3 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -168.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.71 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 1.8 t -64.28 112.79 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.936 0.894 . . . . 0.0 110.79 173.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -82.02 26.63 0.51 Allowed 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.689 0.796 . . . . 0.0 112.773 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 25.7 mm -105.64 -53.17 7.02 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 169.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.542 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 27.3 p -118.5 -109.33 0.36 Allowed 'General case' 0 C--N 1.346 0.443 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 173.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.542 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.02 165.92 29.35 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 108.624 -1.79 . . . . 0.0 108.624 155.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.693 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 23.8 t80 175.61 111.7 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.473 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -105.64 125.58 51.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -171.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.5 t -143.13 165.8 26.42 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.343 0.657 . . . . 0.0 111.622 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -70.18 -42.72 72.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.903 1.281 . . . . 0.0 110.835 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -110.98 131.37 55.1 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.548 0.739 . . . . 0.0 110.525 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -50.86 -37.26 42.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.793 1.237 . . . . 0.0 111.447 172.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -36.95 52.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.254 1.022 . . . . 0.0 112.515 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.8 m -69.47 -55.97 8.74 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.451 0.301 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -41.82 45.03 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -173.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -50.25 -54.18 22.99 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.769 0.827 . . . . 0.0 111.77 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.53 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 58.6 m95 -78.27 -33.92 49.28 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.331 -172.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -45.1 -41.17 7.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 124.049 0.843 . . . . 0.0 112.617 163.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.71 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 33.6 mtm -61.85 -48.01 82.49 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 117.465 0.121 . . . . 0.0 110.892 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.79 -39.54 77.77 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.102 0.876 . . . . 0.0 111.014 176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 31.4 mmmt -59.42 -45.73 90.71 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 124.208 0.943 . . . . 0.0 110.221 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.197 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -172.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 32.6 p . . . . . 0 C--O 1.24 0.589 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.0 t -86.91 124.29 32.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -62.68 -25.86 68.36 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.987 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -92.44 -42.99 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.013 0.525 . . . . 0.0 112.221 -172.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.14 8.4 2.94 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 119.628 1.104 . . . . 0.0 113.142 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.4 37.43 18.71 Favored Glycine 0 N--CA 1.483 1.797 0 N-CA-C 117.769 1.868 . . . . 0.0 117.769 165.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -68.54 -26.98 65.7 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.855 0.827 . . . . 0.0 113.047 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.635 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.0 OUTLIER 77.61 121.36 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.667 1.587 . . . . 0.0 110.263 -172.335 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -119.32 170.19 9.33 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.945 0.898 . . . . 0.0 110.554 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.693 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 1.7 mm-40 -68.93 -28.64 66.83 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.799 -175.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -162.58 165.77 25.54 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.935 0.894 . . . . 0.0 109.31 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -60.65 -37.39 81.38 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.106 0.962 . . . . 0.0 111.009 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.85 -37.85 88.91 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.195 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.5 m -66.01 -29.97 70.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.966 0.506 . . . . 0.0 111.146 177.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 75.8 t -73.68 -48.58 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.268 1.027 . . . . 0.0 110.237 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.0 t -73.61 -34.48 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.874 -175.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.2 86.35 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.27 174.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -72.46 -32.65 66.43 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.346 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -70.23 -36.68 74.68 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.255 1.022 . . . . 0.0 109.362 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . 0.41 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . . . -62.87 -36.36 83.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.749 175.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -87.97 -47.76 8.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.386 -171.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.6 t -104.13 -6.23 21.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.994 0.917 . . . . 0.0 111.763 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 . . . . . 0 CA--C 1.57 1.736 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.687 176.848 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 121.799 0.809 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -148.53 95.5 2.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.8 1.24 . . . . 0.0 107.747 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -93.92 102.58 14.68 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.419 -178.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.0 mm -101.75 104.83 16.94 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.605 -166.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 18' ' ' TYR . 7.6 t -60.04 92.95 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 160.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 32.23 -62.23 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 128.772 2.829 . . . . 0.0 115.502 166.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 16' ' ' CYS . 3.2 t80 -134.67 -41.9 0.77 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.616 0.767 . . . . 0.0 110.155 -175.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -97.79 34.59 1.85 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.181 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.37 122.54 26.52 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.783 0.433 . . . . 0.0 111.126 159.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -69.37 -53.01 21.67 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 168.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -174.69 125.8 0.29 Allowed 'General case' 0 C--N 1.362 1.141 0 C-N-CA 123.926 0.89 . . . . 0.0 109.868 163.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -96.82 146.49 24.87 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -67.05 -29.81 69.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.946 0.499 . . . . 0.0 111.164 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -162.59 158.21 23.07 Favored 'General case' 0 CA--C 1.557 1.241 0 CA-C-O 120.993 0.425 . . . . 0.0 111.158 -173.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.8 p -65.25 -31.06 72.02 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -74.42 -36.7 63.46 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.359 0.527 . . . . 0.0 111.043 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -58.72 -48.29 81.65 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.697 1.237 . . . . 0.0 109.606 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.23 -43.53 78.7 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.801 -2.0 . . . . 0.0 112.383 169.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.42 65.07 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.801 0.84 . . . . 0.0 112.679 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.476 ' HA ' ' HB ' ' A' ' 50' ' ' THR . 61.1 t -61.05 -46.82 95.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.488 0.715 . . . . 0.0 110.532 176.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -73.81 -39.61 63.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.86 0.864 . . . . 0.0 111.069 174.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 43.0 ttt180 -69.35 -1.93 9.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.685 1.194 . . . . 0.0 111.965 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.543 ' SD ' ' NE2' ' A' ' 43' ' ' GLN . 24.9 ptt? -45.38 -16.5 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.985 1.714 . . . . 0.0 114.79 174.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -86.77 -56.89 4.75 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.706 0 C-N-CA 125.379 1.471 . . . . 0.0 110.046 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.83 6.43 36.59 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -172.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.616 HG23 ' HD3' ' A' ' 41' ' ' PRO . 5.2 t -62.15 -49.66 74.97 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -169.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.28 -30.33 3.71 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 119.917 -0.38 . . . . 0.0 112.735 -169.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -70.03 -16.47 63.16 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.087 0.955 . . . . 0.0 113.217 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HZ1' ' HB2' ' A' ' 40' ' ' LYS . 0.0 OUTLIER 45.08 82.14 0.24 Allowed Pre-proline 0 CA--C 1.563 1.476 0 C-N-CA 125.279 1.431 . . . . 0.0 112.706 -176.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . 0.616 ' HD3' HG23 ' A' ' 37' ' ' THR . 2.1 Cg_endo -83.3 173.58 9.7 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.292 2.661 . . . . 0.0 110.482 172.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 mp -97.92 131.37 44.44 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -173.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' SD ' ' A' ' 34' ' ' MET . 33.4 tt0 -120.32 141.42 50.04 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.733 0.413 . . . . 0.0 110.503 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.587 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.7 t -64.65 108.53 1.73 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.645 0.778 . . . . 0.0 109.573 169.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.83 6.28 2.66 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.32 1.048 . . . . 0.0 112.644 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.587 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 mp -90.73 -51.59 11.6 Favored 'Isoleucine or valine' 0 C--N 1.354 0.802 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -174.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 25.0 p -119.94 -112.75 0.33 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.36 158.27 27.66 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 108.253 -1.939 . . . . 0.0 108.253 157.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.421 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.7 t80 172.04 110.46 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 102.216 -3.253 . . . . 0.0 102.216 -175.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.476 ' HB ' ' HA ' ' A' ' 31' ' ' VAL . 2.7 m -119.64 137.12 54.08 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -167.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.501 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 8.1 p -160.11 155.93 25.96 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.994 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 2.68 45.05 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.515 175.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -105.21 103.99 13.63 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 124.548 1.139 . . . . 0.0 108.345 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -50.73 -45.36 58.61 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.373 0.669 . . . . 0.0 111.268 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.65 -39.78 68.37 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.424 1.077 . . . . 0.0 112.783 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.501 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 22.9 t -61.47 -54.9 37.34 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.231 0.612 . . . . 0.0 111.79 -174.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -75.14 -35.91 61.63 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.793 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -50.66 -41.63 55.68 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.021 0.929 . . . . 0.0 112.733 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.432 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 93.7 m95 -80.67 -54.53 5.55 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.399 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -41.28 -46.63 3.26 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.462 ' HE1' HD11 ' A' ' 46' ' ' ILE . 23.4 ptm -61.52 -46.97 87.7 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -68.42 -36.58 79.28 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.489 0.661 . . . . 0.0 111.522 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 29.4 mmmt -67.05 -33.94 76.6 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.017 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 121.532 0.682 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 6.6 t -103.72 118.1 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 167.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.56 -22.81 66.73 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.047 0.385 . . . . 0.0 111.377 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mt -84.24 -41.73 16.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 122.78 0.432 . . . . 0.0 111.499 -172.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.7 p -136.92 -0.61 2.28 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.3 39.15 96.83 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 114.613 0.605 . . . . 0.0 114.613 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -64.49 -38.0 89.49 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.016 0.526 . . . . 0.0 111.212 -176.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 74.64 114.81 0.06 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.449 1.499 . . . . 0.0 110.014 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -122.19 163.63 19.23 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.302 0.641 . . . . 0.0 109.937 -179.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.99 -1.4 52.47 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -158.62 144.67 16.89 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.671 0.788 . . . . 0.0 108.919 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -58.22 -27.52 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.459 1.104 . . . . 0.0 110.937 174.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -54.54 -44.7 73.06 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.544 0.738 . . . . 0.0 110.813 173.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -70.24 -29.04 65.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.509 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.27 -45.35 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 123.972 0.909 . . . . 0.0 110.494 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 88.5 t -71.44 -37.6 65.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.341 1.056 . . . . 0.0 109.147 -176.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.63 78.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.847 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -72.13 -33.89 68.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.449 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -73.59 -33.28 64.54 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.349 0.595 . . . . 0.0 109.482 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.58 71.54 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.016 174.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -87.96 -58.77 2.45 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-O 121.473 0.654 . . . . 0.0 111.448 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.5 t -91.78 -8.18 47.48 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.878 1.271 . . . . 0.0 111.554 -167.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 CA--C 1.564 1.514 0 C-N-CA 123.112 0.565 . . . . 0.0 111.084 179.256 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -127.15 89.38 2.96 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -174.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . 0.428 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 63.0 m-85 -93.09 113.75 26.09 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.197 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.648 HG21 ' H ' ' A' ' 17' ' ' GLU . 9.5 mm -119.69 158.67 21.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 124.562 1.145 . . . . 0.0 108.491 -170.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.581 ' H ' ' HB2' ' A' ' 20' ' ' ALA . 48.9 t -104.39 -10.03 18.04 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.828 0.851 . . . . 0.0 110.572 176.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.648 ' H ' HG21 ' A' ' 15' ' ' ILE . 3.1 mp0 88.65 -16.49 0.3 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.745 2.018 . . . . 0.0 112.391 170.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -134.86 -51.54 0.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.9 p -122.67 74.2 1.18 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.698 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.581 ' HB2' ' H ' ' A' ' 16' ' ' CYS . . . -164.13 146.23 8.99 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.58 0.705 . . . . 0.0 112.229 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -77.9 -171.26 2.2 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 113.831 -1.531 . . . . 0.0 108.979 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.61 125.24 30.96 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.46 ' HB3' ' HB2' ' A' ' 28' ' ' ASN . 67.9 m-85 -110.23 147.54 33.58 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.058 0.543 . . . . 0.0 110.654 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -58.62 -37.22 75.43 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.119 0.968 . . . . 0.0 112.38 175.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.6 t -147.59 156.05 42.42 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.061 0.458 . . . . 0.0 111.103 -167.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.2 p -57.02 -27.08 61.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.662 -1.153 . . . . 0.0 111.551 171.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 36.7 t60 -70.99 -41.04 71.49 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.945 0.498 . . . . 0.0 110.625 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.46 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 2.3 m-20 -60.75 -49.62 76.78 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.021 0.915 . . . . 0.0 110.209 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 tp -63.83 -35.56 81.02 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.45 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.95 -31.98 71.52 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 123.444 0.697 . . . . 0.0 112.443 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.469 HG12 ' HB ' ' A' ' 50' ' ' THR . 79.0 t -64.08 -49.4 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -60.07 -39.18 85.17 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.773 0.829 . . . . 0.0 110.913 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -67.13 2.09 1.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.07 1.348 . . . . 0.0 111.73 -175.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.9 ptp -44.97 -22.95 0.11 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.58 1.552 . . . . 0.0 113.482 172.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.11 -50.59 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.772 1.229 . . . . 0.0 110.042 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -98.26 6.44 47.4 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.162 0.585 . . . . 0.0 111.638 -171.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -58.84 -60.19 4.23 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -164.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.48 -32.19 0.99 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 122.929 0.3 . . . . 0.0 113.335 -168.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.17 -42.83 75.37 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.749 1.219 . . . . 0.0 110.16 171.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 68.4 100.76 0.04 OUTLIER Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.729 1.611 . . . . 0.0 111.091 -171.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.87 -162.81 0.11 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.815 2.343 . . . . 0.0 111.603 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.417 HD11 ' N ' ' A' ' 54' ' ' LYS . 43.7 mt -100.01 106.34 18.11 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -132.33 135.51 46.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.539 0.736 . . . . 0.0 110.236 -169.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.32 107.79 1.73 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.108 0.963 . . . . 0.0 110.805 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -87.96 56.38 3.85 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.899 0.857 . . . . 0.0 110.811 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mm -125.93 -54.35 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 164.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.5 p -119.37 -116.99 0.32 Allowed 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 176.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -146.15 164.07 28.33 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 155.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.1 t80 171.25 113.1 0.01 OUTLIER 'General case' 0 C--N 1.348 0.511 0 N-CA-C 101.794 -3.41 . . . . 0.0 101.794 -174.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.469 ' HB ' HG12 ' A' ' 31' ' ' VAL . 8.0 m -121.75 129.5 52.74 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -170.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.6 t -141.01 163.12 33.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.637 -175.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -76.47 -21.04 56.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.493 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -117.76 116.23 26.6 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.483 1.113 . . . . 0.0 109.636 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.417 ' N ' HD11 ' A' ' 42' ' ' LEU . 63.4 tttm -57.61 -34.77 69.62 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.142 0.977 . . . . 0.0 111.801 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.65 70.97 Favored 'General case' 0 CA--C 1.554 1.122 0 O-C-N 123.846 0.716 . . . . 0.0 112.301 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -61.85 -55.27 31.63 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.745 0.418 . . . . 0.0 111.3 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.405 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -71.26 -27.93 63.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.133 0.573 . . . . 0.0 111.687 178.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -52.58 -44.12 65.72 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.721 0.808 . . . . 0.0 112.396 171.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -76.72 -45.83 27.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.405 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 63.8 t60 -45.94 -40.93 10.92 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 168.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.412 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 66.8 mtm -71.82 -37.4 70.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.384 -0.823 . . . . 0.0 112.624 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -56.89 -32.15 65.59 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 168.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -67.96 -42.39 81.0 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.4 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 84.7 m-70 . . . . . 0 N--CA 1.49 1.566 0 C-N-CA 123.235 0.614 . . . . 0.0 111.389 171.541 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.5 p . . . . . 0 C--O 1.238 0.493 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.42 115.58 7.21 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -61.24 -19.25 61.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.182 0.593 . . . . 0.0 111.707 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 mt -96.12 -42.97 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.232 0 C-N-CA 123.62 0.768 . . . . 0.0 112.149 -175.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . 0.595 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.8 p -135.29 -5.11 2.33 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.44 1.018 . . . . 0.0 113.24 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.57 32.25 77.57 Favored Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.102 0.382 . . . . 0.0 113.873 176.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.595 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 52.9 tttm -69.89 -15.8 63.13 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -170.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt 76.13 112.68 0.07 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 124.52 1.128 . . . . 0.0 111.933 167.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -133.87 148.62 51.28 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.598 0.759 . . . . 0.0 111.847 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.57 -18.48 65.02 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.907 1.283 . . . . 0.0 113.821 -174.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.56 ' HZ1' ' HB3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -144.84 148.31 33.85 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.46 -29.99 71.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.658 0.783 . . . . 0.0 110.288 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -56.6 -41.67 77.42 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.295 170.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.427 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 43.3 t -69.02 -30.42 68.79 Favored 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 122.951 0.5 . . . . 0.0 110.944 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.56 -44.49 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.737 0.815 . . . . 0.0 109.745 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -74.13 -36.35 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.141 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.22 -40.44 94.11 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.936 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.97 -29.64 66.8 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.765 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -72.09 -40.79 67.98 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.466 0.65 . . . . 0.0 109.77 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.0 63.08 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.637 178.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -98.78 -51.69 3.82 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.373 1.069 . . . . 0.0 112.029 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.3 t -92.85 -14.03 28.26 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.858 1.263 . . . . 0.0 111.405 -169.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.4 m-70 . . . . . 0 CA--C 1.556 1.199 0 C-N-CA 122.835 0.454 . . . . 0.0 110.956 179.927 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -125.92 83.92 2.22 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.514 -1.221 . . . . 0.0 107.909 -173.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -81.93 115.3 21.04 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.9 -1.5 . . . . 0.0 110.024 -175.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.4 mm -105.31 137.49 34.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.582 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 43.5 t -80.93 -24.73 37.96 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.211 0.604 . . . . 0.0 110.256 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 117.5 -28.63 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 127.728 2.411 . . . . 0.0 110.541 167.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -133.06 -42.4 0.89 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.114 0.966 . . . . 0.0 108.587 -173.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 66.76 1.01 Allowed 'General case' 0 C--O 1.242 0.68 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.242 -178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.582 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.04 124.2 1.5 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.989 162.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -67.74 -52.73 34.01 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 169.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -178.05 132.11 0.15 Allowed 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.393 1.477 . . . . 0.0 108.575 163.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -100.17 135.2 41.96 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 170.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -73.79 -10.99 60.23 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.262 0.625 . . . . 0.0 111.375 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -146.91 134.99 21.54 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 122.751 0.42 . . . . 0.0 110.833 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' SER . . . . . 0.619 ' HA ' HD22 ' A' ' 29' ' ' LEU . 20.1 m -59.82 -34.82 73.57 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.432 1.093 . . . . 0.0 111.588 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -62.36 -44.81 95.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.045 0.938 . . . . 0.0 110.748 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -66.89 -42.53 85.35 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.739 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.619 HD22 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -62.68 -34.87 78.01 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.439 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.67 69.16 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 123.754 0.659 . . . . 0.0 111.985 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.416 HG22 ' HD3' ' A' ' 52' ' ' ARG . 39.6 t -63.92 -47.76 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -62.87 -39.9 95.85 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.194 0.998 . . . . 0.0 110.534 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.425 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 41.8 ttt180 -68.62 5.94 0.95 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.41 1.084 . . . . 0.0 111.842 -173.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.6 ptp -42.87 -20.8 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 126.512 1.925 . . . . 0.0 114.853 176.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.32 -58.46 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 108.637 178.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.425 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.54 10.52 37.03 Favored 'General case' 0 N--CA 1.501 2.113 0 C-N-CA 124.458 1.103 . . . . 0.0 113.137 -170.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 39' ' ' GLU . 4.5 t -57.8 -65.12 0.69 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -164.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.67 36.4 91.24 Favored Glycine 0 N--CA 1.476 1.357 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.418 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 37.1 mt-10 -149.86 -34.77 0.17 Allowed 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.902 1.681 . . . . 0.0 107.781 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt 46.77 75.93 0.61 Allowed Pre-proline 0 C--N 1.371 1.539 0 C-N-CA 126.263 1.825 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.36 -74.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.382 2.33 0 C-N-CA 123.107 2.538 . . . . 0.0 111.842 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 51' ' ' CYS . 95.4 mt -145.49 98.94 3.22 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.435 ' HG2' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -129.85 141.76 50.78 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -168.444 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.6 t -66.1 102.9 0.87 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.97 -1.47 19.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.828 0.851 . . . . 0.0 111.945 177.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.492 HD12 ' SD ' ' A' ' 61' ' ' MET . 3.4 mp -83.8 -55.6 6.91 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 N-CA-C 107.103 -1.444 . . . . 0.0 107.103 174.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 18.3 p -132.58 -97.92 0.3 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.396 176.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.476 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -155.46 131.19 3.0 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 116.906 -2.052 . . . . 0.0 109.078 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.0 t80 164.83 113.56 0.01 OUTLIER 'General case' 0 C--N 1.354 0.804 0 N-CA-C 102.402 -3.184 . . . . 0.0 102.402 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.435 ' OG1' ' HG2' ' A' ' 43' ' ' GLN . 3.1 m -128.42 126.51 40.72 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 96.4 m -150.45 141.74 23.25 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.442 -175.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HD3' HG22 ' A' ' 31' ' ' VAL . 29.9 ptt180 -69.66 -12.19 61.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.588 0.755 . . . . 0.0 111.147 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -101.02 107.76 19.3 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.35 -41.77 29.51 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.127 1.371 . . . . 0.0 111.65 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.87 -29.48 59.99 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.68 -1.145 . . . . 0.0 113.023 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.2 m -69.41 -56.34 7.74 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.134 -0.354 . . . . 0.0 111.816 179.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -48.49 21.78 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -55.89 -31.38 62.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.446 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 27.2 m95 -83.98 -39.59 19.53 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.305 178.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -45.88 -37.86 6.76 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.492 ' SD ' HD12 ' A' ' 46' ' ' ILE . 23.0 ttp -62.61 -47.03 85.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.754 0.822 . . . . 0.0 111.252 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.75 -36.97 80.26 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.538 0.735 . . . . 0.0 111.24 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 64.2 mttm -62.58 -33.94 75.97 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.624 0.769 . . . . 0.0 111.255 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.422 ' CD2' ' HA ' ' A' ' 61' ' ' MET . 3.1 p80 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--O 1.237 0.41 0 CA-C-O 121.101 0.477 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.2 t -89.12 118.81 29.11 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 105.944 -1.872 . . . . 0.0 105.944 168.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.41 -19.81 65.9 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-O 121.024 0.44 . . . . 0.0 111.501 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -88.15 -37.32 10.39 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.279 0 C-N-CA 123.029 0.532 . . . . 0.0 111.785 -173.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.3 p -150.33 17.07 0.83 Allowed 'General case' 0 C--N 1.377 1.778 0 CA-C-N 119.449 1.022 . . . . 0.0 113.393 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 49.35 46.48 35.81 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 117.286 1.675 . . . . 0.0 117.286 160.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.68 -45.1 88.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 117.313 0.557 . . . . 0.0 111.241 173.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.517 ' HB2' ' HZ1' ' A' ' 80' ' ' LYS . 0.2 OUTLIER 69.07 112.72 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.484 1.114 . . . . 0.0 109.447 -167.813 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -111.32 167.89 9.95 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.209 1.004 . . . . 0.0 110.625 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.29 -31.51 71.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.179 0.592 . . . . 0.0 112.473 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.7 155.59 47.28 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.068 0.461 . . . . 0.0 110.403 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -62.43 -31.14 71.8 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.305 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -59.28 -38.54 80.4 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.513 0.725 . . . . 0.0 110.592 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 67.6 m -70.28 -29.63 66.44 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 122.764 0.426 . . . . 0.0 111.571 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.06 -43.8 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.422 0.689 . . . . 0.0 109.688 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 80.6 t -71.57 -38.26 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.955 1.302 . . . . 0.0 109.239 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.01 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.71 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -72.32 -40.91 67.13 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.479 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -70.69 -38.6 73.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.77 0.828 . . . . 0.0 109.362 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.62 -28.81 68.05 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.451 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -91.62 -45.07 8.67 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.872 0.869 . . . . 0.0 111.207 -173.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.5 t -94.08 -23.35 18.01 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.746 1.219 . . . . 0.0 111.191 -169.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 . . . . . 0 CA--C 1.569 1.677 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -176.388 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.66 80.98 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -169.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -81.97 104.23 12.18 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.842 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -113.38 157.59 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 124.286 1.034 . . . . 0.0 109.777 -171.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.9 t -119.75 37.15 4.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.267 1.427 . . . . 0.0 108.149 -173.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 53.17 -37.46 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 127.827 2.451 . . . . 0.0 117.144 -172.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -133.86 -48.84 0.81 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.899 0.88 . . . . 0.0 110.629 -167.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -113.5 29.98 7.58 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.954 -168.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.29 142.11 46.22 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.89 0.852 . . . . 0.0 111.825 167.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -72.54 -114.53 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 113.363 -1.744 . . . . 0.0 108.178 164.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -137.2 124.41 21.75 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 161.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -109.1 136.6 48.33 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -87.98 0.71 55.57 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 t -146.26 140.4 26.48 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 122.885 0.474 . . . . 0.0 110.126 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.0 m -46.09 -56.77 5.16 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.361 1.465 . . . . 0.0 113.266 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.44 ' O ' HG21 ' A' ' 31' ' ' VAL . 93.5 m-70 -69.34 -33.54 73.26 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.677 0.791 . . . . 0.0 111.776 -175.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -51.32 -55.37 18.73 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.063 0.945 . . . . 0.0 111.446 175.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.38 -45.7 87.79 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 114.889 -1.05 . . . . 0.0 112.187 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.66 -27.52 50.37 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.606 0.763 . . . . 0.0 112.785 178.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.44 HG21 ' O ' ' A' ' 27' ' ' HIS . 63.1 t -64.98 -51.14 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.358 0.663 . . . . 0.0 110.417 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -61.57 -40.11 93.55 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.382 0.673 . . . . 0.0 109.831 175.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.423 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 39.4 ttt180 -67.26 4.71 0.88 Allowed 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.622 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -45.46 -17.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 125.708 1.603 . . . . 0.0 114.957 174.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.99 -59.69 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.43 0 C-N-CA 125.128 1.371 . . . . 0.0 109.213 176.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.423 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -102.05 9.35 40.43 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.132 0.973 . . . . 0.0 112.98 -171.065 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.5 t -58.53 -56.39 22.7 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.89 0.876 . . . . 0.0 113.247 -170.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.18 -32.07 3.08 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 119.835 -0.425 . . . . 0.0 112.544 -170.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.13 -37.27 69.49 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 123.729 0.812 . . . . 0.0 111.306 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 68.02 110.35 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.927 1.291 . . . . 0.0 111.599 -170.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.84 -164.65 0.28 Allowed 'Trans proline' 0 C--N 1.383 2.354 0 C-N-CA 122.551 2.167 . . . . 0.0 110.352 165.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.6 mt -117.12 104.25 11.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.233 0.613 . . . . 0.0 109.48 -177.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . 0.479 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 24.3 tm0? -127.25 141.39 51.74 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.682 0.793 . . . . 0.0 109.077 -168.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 t -69.49 107.98 3.59 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.612 0.765 . . . . 0.0 111.648 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -55.93 -27.54 52.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.73 1.212 . . . . 0.0 113.312 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.18 -57.51 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 122.736 0.414 . . . . 0.0 109.919 -174.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.5 p -129.45 -88.44 0.51 Allowed 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -154.08 145.9 13.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 116.997 -2.002 . . . . 0.0 108.781 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.479 ' O ' ' HA ' ' A' ' 43' ' ' GLN . 20.1 t80 165.5 110.91 0.01 OUTLIER 'General case' 0 C--N 1.358 0.954 0 N-CA-C 102.302 -3.221 . . . . 0.0 102.302 166.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -118.85 136.3 54.1 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -174.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.519 ' SG ' HD21 ' A' ' 57' ' ' LEU . 25.7 p -157.33 -173.99 4.68 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.759 -176.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.423 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.75 13.38 7.43 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.739 0.815 . . . . 0.0 109.029 172.215 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -121.63 104.94 9.99 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.652 1.181 . . . . 0.0 108.303 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -55.97 -31.78 63.31 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.439 1.096 . . . . 0.0 112.918 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.03 -43.08 91.58 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.49 1.119 . . . . 0.0 111.903 174.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -61.25 -55.89 26.87 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.452 0.701 . . . . 0.0 112.187 -171.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.519 HD21 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -75.4 -27.37 59.03 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.576 178.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -50.21 -44.97 53.4 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -80.79 -37.77 29.66 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 122.358 -0.214 . . . . 0.0 110.596 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 63' ' ' LYS . 83.1 t60 -48.5 -43.12 34.77 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.9 ptm -72.66 -33.84 66.84 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 119.218 0.917 . . . . 0.0 112.285 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -28.01 64.61 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.403 0.681 . . . . 0.0 111.183 168.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 60' ' ' HIS . 28.6 mtpp -72.39 -36.79 68.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.451 0.7 . . . . 0.0 110.364 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 . . . . . 0 N--CA 1.491 1.598 0 C-N-CA 123.507 0.723 . . . . 0.0 111.437 177.026 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.5 p . . . . . 0 C--O 1.237 0.419 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . 0.434 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 6.2 t -67.39 122.91 18.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 169.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -53.51 -26.86 22.6 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.8 mt -109.42 -25.94 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.566 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -171.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 p -140.37 5.23 2.04 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-N 120.474 1.488 . . . . 0.0 113.258 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 51.88 42.86 54.27 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 114.695 0.638 . . . . 0.0 114.695 174.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.434 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 3.8 tmtp? -65.51 -39.01 91.34 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -176.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.58 122.59 0.05 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 125.065 1.346 . . . . 0.0 111.408 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.4 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.5 m-85 -135.68 148.62 48.99 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.123 1.369 . . . . 0.0 108.444 176.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.8 -19.27 65.71 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -174.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.35 140.7 47.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 124.418 1.087 . . . . 0.0 108.14 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . 0.452 ' HB3' ' HZ1' ' A' ' 84' ' ' LYS . 8.5 mtpm? -58.88 -27.85 65.58 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.266 1.026 . . . . 0.0 110.653 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -56.88 -47.14 81.14 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.346 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.7 m -67.43 -27.68 67.26 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 122.431 0.292 . . . . 0.0 111.702 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t -71.22 -44.5 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.425 0.69 . . . . 0.0 110.098 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 79.5 t -73.78 -38.18 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.846 1.258 . . . . 0.0 109.592 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.01 96.23 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.521 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -73.32 -38.56 65.76 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.073 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . 0.561 ' HB3' ' HZ3' ' A' ' 91' ' ' LYS . 6.3 ttpm? -72.57 -37.71 68.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.963 0.505 . . . . 0.0 110.947 -169.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.74 -30.39 69.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.103 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -90.15 -46.31 8.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.835 0.854 . . . . 0.0 111.643 -171.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 42.4 t -88.16 -19.04 27.48 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.463 1.105 . . . . 0.0 110.652 -172.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 . . . . . 0 CA--C 1.557 1.225 0 C-N-CA 123.649 0.78 . . . . 0.0 109.246 -176.615 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.499 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 15.8 m-20 -121.99 86.09 2.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.52 -162.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -93.64 111.6 23.31 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.498 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.409 ' HA ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 mm -108.35 145.67 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.558 -167.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.532 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 39.2 t -98.64 44.29 1.04 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 55.86 -40.53 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.226 2.61 . . . . 0.0 115.822 -172.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -134.94 -43.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.991 1.316 . . . . 0.0 109.414 -165.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -117.69 53.61 0.93 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.696 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.532 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -154.22 127.49 8.46 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.992 158.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -58.44 3.94 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 171.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.499 ' HB3' ' HA ' ' A' ' 13' ' ' ASP . . . -170.47 127.37 0.79 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.38 0.672 . . . . 0.0 110.867 164.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.66 157.72 16.75 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.443 0.697 . . . . 0.0 109.13 171.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -59.59 -36.08 75.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.156 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.2 m -145.75 155.85 43.22 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.223 0.535 . . . . 0.0 111.068 -176.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 p -59.03 -34.51 71.99 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.979 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -73.74 -33.16 64.21 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.269 0.628 . . . . 0.0 110.601 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.15 -50.94 69.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.278 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.415 HD11 ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -63.49 -33.14 74.92 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.374 0.67 . . . . 0.0 111.406 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.443 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -53.75 -27.51 28.99 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.425 1.078 . . . . 0.0 112.198 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 89.6 t -64.61 -48.06 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.864 0.865 . . . . 0.0 111.347 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.88 -37.84 82.28 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.642 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 52.4 ttt85 -62.64 -3.43 1.49 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.718 1.607 . . . . 0.0 112.615 -177.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 20.8 ptt? -45.06 -16.19 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.4 tp -85.51 -51.3 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 C-N-CA 125.358 1.463 . . . . 0.0 110.027 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.62 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -104.6 11.71 33.9 Favored 'General case' 0 N--CA 1.508 2.472 0 C-N-CA 125.158 1.383 . . . . 0.0 112.996 -178.311 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.642 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 7.1 t -57.95 -55.05 39.88 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -161.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.05 36.69 91.08 Favored Glycine 0 N--CA 1.473 1.164 0 N-CA-C 112.025 -0.43 . . . . 0.0 112.025 -171.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.404 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 33.7 mt-10 -158.82 -58.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -168.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 76.58 97.45 0.04 OUTLIER Pre-proline 0 C--N 1.352 0.708 0 C-N-CA 126.824 2.05 . . . . 0.0 111.504 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.33 172.16 12.71 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 122.508 2.139 . . . . 0.0 110.915 164.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -89.34 138.51 31.37 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -139.39 136.79 35.08 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.242 0.339 . . . . 0.0 110.277 -171.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.536 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 3.9 t -70.56 106.39 3.45 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.875 0.87 . . . . 0.0 109.433 175.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.33 16.65 1.23 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.834 0.854 . . . . 0.0 112.646 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.536 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 3.5 mp -94.53 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.351 0.656 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.515 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 23.7 p -116.32 -108.38 0.37 Allowed 'General case' 0 C--O 1.24 0.571 0 N-CA-C 104.206 -2.516 . . . . 0.0 104.206 172.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.515 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.09 159.85 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 108.593 -1.803 . . . . 0.0 108.593 155.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 15.4 t80 174.08 111.16 0.02 OUTLIER 'General case' 0 C--N 1.353 0.737 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.0 m -119.73 135.25 54.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -171.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.8 t -157.31 157.96 35.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.728 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.464 ' HD2' ' N ' ' A' ' 53' ' ' GLN . 2.2 ppt_? -78.47 -21.82 48.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.526 -1.215 . . . . 0.0 111.677 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.464 ' N ' ' HD2' ' A' ' 52' ' ' ARG . 8.0 tp60 -98.62 115.84 29.52 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -174.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.592 ' HZ2' ' HB3' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -55.22 -34.27 63.8 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 176.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.98 -41.43 71.19 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 124.266 0.979 . . . . 0.0 111.85 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.2 m -57.42 -56.48 21.31 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.274 0.63 . . . . 0.0 112.174 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 2.2 pt? -76.29 -27.62 56.7 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.048 0.539 . . . . 0.0 111.969 177.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -50.4 -46.79 56.47 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 123.616 0.766 . . . . 0.0 112.59 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -81.02 -46.06 15.62 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 78.6 t60 -45.53 -43.09 11.59 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.6 ptm -63.1 -39.76 95.64 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 118.667 0.667 . . . . 0.0 111.459 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.86 -24.92 64.4 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 122.827 0.451 . . . . 0.0 111.625 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.3 -29.95 71.18 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.5 0.32 . . . . 0.0 110.693 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 N--CA 1.494 1.746 0 C-N-CA 124.083 0.953 . . . . 0.0 112.106 178.018 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 36.2 t -96.68 124.09 40.56 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 162.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -62.45 -20.42 64.52 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 mt -104.11 -37.05 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.8 p -134.62 13.09 3.74 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 119.62 1.1 . . . . 0.0 113.007 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 50.36 32.83 23.04 Favored Glycine 0 C--N 1.358 1.753 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 171.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -63.69 -35.17 79.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.889 0.876 . . . . 0.0 112.57 -174.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? 75.09 115.61 0.06 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.384 1.074 . . . . 0.0 109.948 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -124.22 154.6 39.92 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.769 0.827 . . . . 0.0 111.475 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.43 -41.26 98.58 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.434 1.094 . . . . 0.0 111.354 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.491 ' HB2' ' H ' ' A' ' 86' ' ' SER . 35.4 mtpt -121.61 144.59 48.66 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 123.823 0.849 . . . . 0.0 108.747 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 52.3 mtmt -65.03 -31.21 72.33 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.091 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . 0.422 ' HB3' ' HE2' ' A' ' 83' ' ' LYS . 33.1 t70 -54.61 -46.0 73.76 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.387 1.075 . . . . 0.0 110.578 170.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.491 ' H ' ' HB2' ' A' ' 83' ' ' LYS . 19.7 m -62.53 -32.44 73.38 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 123.336 0.397 . . . . 0.0 111.993 176.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 45.2 t -74.62 -45.03 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.128 0.571 . . . . 0.0 110.113 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.3 t -70.92 -37.69 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.45 1.1 . . . . 0.0 109.29 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.14 -38.43 82.16 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.673 -1.148 . . . . 0.0 109.511 177.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -73.06 -33.83 65.89 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.603 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -73.69 -45.75 50.45 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.199 0.599 . . . . 0.0 110.35 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.11 -21.0 66.33 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.672 0.789 . . . . 0.0 111.825 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -100.28 -49.96 4.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.995 0.918 . . . . 0.0 111.982 -175.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 28.6 t -99.81 -4.35 30.7 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.189 0.996 . . . . 0.0 111.427 -168.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 . . . . . 0 CA--C 1.568 1.651 0 C-N-CA 124.05 0.94 . . . . 0.0 110.804 179.681 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 122.219 1.009 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . 0.496 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 4.7 m-20 -134.72 93.72 3.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.704 1.202 . . . . 0.0 108.362 -167.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -79.36 113.59 17.62 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.244 1.418 . . . . 0.0 109.948 177.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.8 mt -109.6 134.04 52.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 C-N-CA 123.585 0.754 . . . . 0.0 110.338 -175.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.42 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 9.9 t -80.16 103.01 9.74 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 159.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.97 -15.01 7.47 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.613 1.165 . . . . 0.0 112.834 -168.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.93 -40.16 5.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.005 0.522 . . . . 0.0 110.485 -171.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -141.8 48.84 1.6 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.356 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . 0.42 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -155.54 148.28 24.21 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 163.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 10.5 ptp180 -71.86 -72.49 0.22 Allowed 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.785 168.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 13' ' ' ASP . . . -171.15 154.63 4.1 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.234 1.013 . . . . 0.0 109.696 172.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -131.72 143.14 50.05 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.523 0.729 . . . . 0.0 109.335 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.17 -7.67 50.44 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.7 m -149.9 152.85 35.7 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.231 0.612 . . . . 0.0 110.395 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.0 t -61.5 -34.39 75.43 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.7 0.8 . . . . 0.0 111.726 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -73.28 -37.62 66.19 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.766 0.426 . . . . 0.0 110.788 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.59 -46.99 80.52 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.953 0.883 . . . . 0.0 109.927 173.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 tp -62.43 -39.12 92.27 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.592 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.549 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -54.33 -28.31 41.79 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.704 0.802 . . . . 0.0 112.496 176.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.0 t -63.73 -43.73 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.11 0.964 . . . . 0.0 111.185 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -70.5 -44.46 67.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.685 0.755 . . . . 0.0 110.391 170.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.549 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 49.7 ttp180 -70.87 4.43 2.58 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.059 -171.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' MET . . . . . 0.409 ' O ' HG22 ' A' ' 50' ' ' THR . 19.8 ptt? -44.82 -20.4 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.184 1.394 . . . . 0.0 114.079 170.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -47.13 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 125.434 1.494 . . . . 0.0 109.346 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -101.19 -11.34 19.61 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -172.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 33' ' ' ARG . 4.5 t -60.1 -41.88 93.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -152.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.8 39.6 89.87 Favored Glycine 0 C--N 1.347 1.17 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.646 -178.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.6 -80.74 0.52 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -171.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 164.05 93.54 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.336 1.854 . . . . 0.0 109.231 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -97.13 -155.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 124.044 3.162 . . . . 0.0 111.08 173.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.3 mt -93.28 83.25 4.58 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -118.97 136.06 54.29 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.745 -171.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.716 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 8.3 t -68.95 106.72 2.84 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.166 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -93.6 53.43 1.86 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.645 1.212 . . . . 0.0 108.056 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.716 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -134.28 -7.14 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 125.938 1.695 . . . . 0.0 108.978 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 13.1 p -178.68 -118.09 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 103.733 -2.691 . . . . 0.0 103.733 -168.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.69 134.68 4.84 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 161.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.8 t80 178.1 117.99 0.04 OUTLIER 'General case' 0 C--N 1.351 0.653 0 N-CA-C 102.481 -3.155 . . . . 0.0 102.481 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 34' ' ' MET . 6.8 m -124.57 147.4 48.47 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.213 0.915 . . . . 0.0 110.141 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.494 ' SG ' HD22 ' A' ' 57' ' ' LEU . 16.2 p -148.9 179.14 8.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.016 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . 0.492 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.35 23.4 6.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.135 1.374 . . . . 0.0 108.142 177.293 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -146.52 118.2 8.07 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.298 -167.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . 0.454 ' HZ1' ' HB2' ' A' ' 54' ' ' LYS . 0.1 OUTLIER -53.83 -47.22 71.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.494 1.118 . . . . 0.0 113.094 -175.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.36 -33.25 70.94 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.0 m -63.65 -55.42 23.69 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.494 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -76.72 -26.35 54.55 Favored 'General case' 0 C--N 1.357 0.9 0 CA-C-N 118.09 0.405 . . . . 0.0 111.33 176.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.58 -49.61 72.28 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 173.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -79.19 -33.38 43.93 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.516 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 85.9 t60 -54.79 -38.51 67.39 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 167.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -31.25 62.57 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 120.127 1.33 . . . . 0.0 110.268 174.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -61.21 -27.78 68.68 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.411 0.684 . . . . 0.0 111.709 167.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 6.4 mmpt? -63.3 -44.64 94.44 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 123.155 0.582 . . . . 0.0 110.864 169.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 N--CA 1.491 1.599 0 C-N-CA 123.306 0.643 . . . . 0.0 111.107 172.112 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 17.5 t -72.61 122.35 21.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 165.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -57.5 -27.04 62.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.186 0.994 . . . . 0.0 112.33 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.1 mt -94.84 -51.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.558 -174.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.0 p -128.82 11.24 6.1 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 119.455 1.025 . . . . 0.0 112.724 -172.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.81 41.69 28.07 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 114.68 0.632 . . . . 0.0 114.68 172.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -66.02 -41.83 90.46 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.4 mptt 72.77 121.57 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.85 1.26 . . . . 0.0 110.771 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -126.39 162.75 24.83 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.242 1.017 . . . . 0.0 111.378 -178.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -69.19 -18.73 63.95 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HG3' ' H ' ' A' ' 86' ' ' SER . 26.0 pttm -147.32 148.63 31.58 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.44 -25.22 67.91 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.326 0.65 . . . . 0.0 110.759 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -61.29 -38.11 85.64 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.349 0.66 . . . . 0.0 110.76 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.413 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 70.8 m -68.98 -30.0 68.33 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.83 0.452 . . . . 0.0 111.1 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 93.7 t -72.39 -44.32 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 C-N-CA 123.475 0.71 . . . . 0.0 109.999 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 68.1 t -72.27 -37.86 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.295 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.08 -37.3 85.46 Favored 'General case' 0 C--N 1.35 0.601 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.615 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -71.7 -31.63 66.96 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.068 0.947 . . . . 0.0 111.245 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -71.47 -37.66 71.32 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.58 0.705 . . . . 0.0 109.103 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.62 -27.47 61.29 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.548 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -88.38 -52.36 5.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.066 0.946 . . . . 0.0 111.183 -174.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.9 t -97.32 -16.49 20.26 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.053 0.941 . . . . 0.0 110.983 -167.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 . . . . . 0 CA--C 1.571 1.771 0 CA-C-O 118.029 -0.986 . . . . 0.0 113.038 -177.878 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 121.746 0.784 . . . . 0.0 108.949 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -132.38 84.28 2.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -170.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.96 118.0 31.73 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 124.989 1.315 . . . . 0.0 109.074 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 17' ' ' GLU . 14.7 mm -125.29 156.61 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -169.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . 0.485 ' HB2' HD13 ' A' ' 29' ' ' LEU . 28.5 t -91.31 12.37 20.61 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.867 0.867 . . . . 0.0 110.285 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.57 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.8 mp0 88.21 -38.22 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.9 2.08 . . . . 0.0 110.705 169.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -139.17 -52.94 0.56 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.379 0.609 . . . . 0.0 109.993 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.8 p -98.52 70.5 1.96 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.218 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -148.97 -172.63 4.16 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 163.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -112.57 -104.5 0.39 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 175.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.76 134.05 22.99 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 161.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -118.26 165.33 13.96 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.572 0.749 . . . . 0.0 109.576 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -103.06 10.33 38.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.747 0.819 . . . . 0.0 111.045 177.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -169.01 139.74 2.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.056 0.943 . . . . 0.0 109.936 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.8 p -73.61 -37.47 65.39 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.182 0.993 . . . . 0.0 110.956 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.35 -35.13 73.37 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.526 177.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . 0.435 ' O ' HG21 ' A' ' 31' ' ' VAL . 55.6 t30 -59.12 -54.18 49.9 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.456 0.646 . . . . 0.0 109.97 170.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . 0.485 HD13 ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -54.66 -30.05 54.2 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.46 1.504 . . . . 0.0 112.439 178.239 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . 0.67 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -52.71 -24.29 8.37 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 28' ' ' ASN . 32.5 m -53.47 -49.12 56.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 170.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -74.94 -46.8 33.19 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.594 0.711 . . . . 0.0 109.273 172.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.67 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 19.2 ttt180 -76.82 41.87 0.29 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.615 1.566 . . . . 0.0 109.428 -173.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -66.79 -57.26 7.42 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.188 -163.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.4 tp -68.27 -26.98 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 168.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.505 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 43.1 m-70 -79.45 -34.86 41.17 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.094 1.77 . . . . 0.0 108.736 -158.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t -70.55 -36.58 73.74 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.268 -166.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.04 -30.71 9.84 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.734 -0.481 . . . . 0.0 112.339 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -46.38 -39.07 9.79 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.812 1.245 . . . . 0.0 114.027 170.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 58.39 87.37 0.14 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.549 1.14 . . . . 0.0 111.535 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.46 -179.48 4.12 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.097 1.865 . . . . 0.0 111.276 166.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.7 mt -111.92 130.72 55.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -111.93 138.03 49.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.174 0.59 . . . . 0.0 109.952 -174.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.436 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 3.5 t -63.31 116.9 5.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.05 0.94 . . . . 0.0 110.231 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.08 33.04 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.945 1.298 . . . . 0.0 112.356 -171.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.9 mm -133.66 -7.0 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 125.074 1.349 . . . . 0.0 108.679 -172.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.536 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 0.8 OUTLIER 174.05 -139.39 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 -160.593 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.536 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -143.46 135.9 6.65 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 108.22 -1.952 . . . . 0.0 108.22 172.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 31.5 t80 179.12 115.23 0.04 OUTLIER 'General case' 0 C--N 1.348 0.54 0 N-CA-C 102.614 -3.106 . . . . 0.0 102.614 -172.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.65 130.29 56.81 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 122.765 0.426 . . . . 0.0 110.255 -166.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 56' ' ' SER . 42.8 t -149.03 151.63 34.86 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.281 -179.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -80.49 -30.34 37.37 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.94 0.896 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -92.5 111.32 22.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.323 1.049 . . . . 0.0 109.12 -176.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -53.7 -35.22 60.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.59 1.156 . . . . 0.0 112.891 -175.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.01 -48.69 77.73 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 123.965 0.791 . . . . 0.0 111.634 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' SER . . . . . 0.632 ' HB2' ' SG ' ' A' ' 51' ' ' CYS . 46.4 m -52.07 -50.96 60.51 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -173.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.433 ' O ' ' HG3' ' A' ' 61' ' ' MET . 0.7 OUTLIER -72.18 -33.62 67.81 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 119.366 -0.35 . . . . 0.0 111.112 177.734 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -57.4 -38.38 74.2 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.853 0.861 . . . . 0.0 111.849 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 72.4 m95 -78.86 -27.42 44.11 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.528 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 16.3 t60 -77.25 -30.06 54.29 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.784 0.833 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.489 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 94.9 mtp -69.05 -38.69 79.26 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.849 0.46 . . . . 0.0 110.426 176.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -64.59 -28.48 69.66 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.175 176.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.528 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 28.9 mmmt -55.96 -36.54 67.93 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.544 0.338 . . . . 0.0 111.371 170.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.489 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 92.3 m-70 . . . . . 0 N--CA 1.495 1.825 0 C-N-CA 123.08 0.552 . . . . 0.0 111.539 176.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.4 p . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.0 120.98 13.04 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.864 0.866 . . . . 0.0 109.417 172.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -57.39 -27.76 62.63 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.34 0.656 . . . . 0.0 112.077 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.1 mt -93.63 -39.35 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -172.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.5 p -135.1 -1.56 2.63 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.83 1.196 . . . . 0.0 113.095 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 58.27 34.19 73.2 Favored Glycine 0 C--N 1.364 2.096 0 N-CA-C 114.624 0.61 . . . . 0.0 114.624 172.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.436 ' HB3' ' CE1' ' A' ' 81' ' ' PHE . 9.2 tmtt? -63.92 -39.57 94.48 Favored 'General case' 0 CA--C 1.56 1.349 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -173.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 79' ' ' LYS . 4.9 mptp? 80.55 119.74 0.05 Allowed 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 124.914 1.285 . . . . 0.0 110.534 -174.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.436 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 79.2 m-85 -133.13 149.06 52.12 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.623 1.169 . . . . 0.0 108.648 176.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -9.1 9.34 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -174.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . 0.418 ' HG3' ' H ' ' A' ' 86' ' ' SER . 24.2 pttm -151.52 147.17 26.5 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 173.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.42 -28.42 68.26 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.063 0.945 . . . . 0.0 110.689 176.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.69 -42.21 74.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.621 0.769 . . . . 0.0 111.462 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' SER . . . . . 0.418 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 75.4 m -71.11 -29.05 64.78 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.202 0.314 . . . . 0.0 111.156 176.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.3 t -72.55 -44.97 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.834 0.854 . . . . 0.0 110.06 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 87.3 t -72.73 -39.46 60.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 C-N-CA 124.73 1.212 . . . . 0.0 109.447 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.35 -37.33 85.1 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.609 177.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -71.92 -32.2 67.13 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.723 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -71.95 -38.75 69.74 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 109.583 -178.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.56 -17.77 59.95 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.024 177.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -97.65 -45.65 6.3 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.459 0.704 . . . . 0.0 111.591 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 45.2 t -100.42 -14.93 18.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.712 1.205 . . . . 0.0 111.409 -168.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 . . . . . 0 CA--C 1.565 1.538 0 C-N-CA 123.826 0.85 . . . . 0.0 109.975 177.769 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 122.367 1.079 . . . . 0.0 108.132 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -120.75 80.99 1.7 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.423 -1.262 . . . . 0.0 107.89 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -78.84 118.38 20.82 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 113.393 -1.731 . . . . 0.0 109.501 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.2 mm -104.02 112.61 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.755 -171.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.5 t -59.99 101.43 0.12 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 161.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 31.48 -64.66 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 128.32 2.648 . . . . 0.0 115.592 160.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -125.04 -40.88 2.13 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.009 -166.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.16 -46.21 9.97 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.953 -163.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.82 127.16 31.42 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -68.74 -62.38 1.41 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.105 161.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.25 126.89 1.18 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.295 0.638 . . . . 0.0 110.833 164.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -98.71 144.72 27.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -71.88 -19.28 61.97 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -143.66 144.3 31.82 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.586 0.754 . . . . 0.0 110.055 -175.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.3 p -58.0 -32.98 68.44 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.853 0.861 . . . . 0.0 111.113 168.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' HIS . . . . . 0.45 ' O ' HG23 ' A' ' 31' ' ' VAL . 24.4 m-70 -68.03 -38.24 82.29 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.545 0.738 . . . . 0.0 109.994 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -49.45 75.24 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.136 0.974 . . . . 0.0 110.344 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -36.59 79.15 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.322 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.49 -30.88 71.93 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.534 1.146 . . . . 0.0 112.284 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 27' ' ' HIS . 48.3 t -66.45 -45.37 89.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.146 0.578 . . . . 0.0 110.443 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -33.66 68.47 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.524 0.729 . . . . 0.0 109.903 177.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' ARG . . . . . 0.511 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 57.6 ttt180 -63.05 -2.55 1.3 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.619 1.168 . . . . 0.0 112.226 -176.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.9 ptm -45.93 -11.6 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 126.241 1.817 . . . . 0.0 114.612 173.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -83.75 -60.96 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.581 2.159 0 C-N-CA 124.934 1.294 . . . . 0.0 109.673 168.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.24 9.85 37.96 Favored 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -172.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -61.81 -56.59 17.8 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -167.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.19 -32.65 3.77 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 123.353 0.501 . . . . 0.0 112.388 -167.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -70.68 -46.56 62.96 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.706 0.802 . . . . 0.0 111.614 176.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt 70.7 94.96 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 125.26 1.424 . . . . 0.0 110.934 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.14 -177.4 2.3 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.512 2.141 . . . . 0.0 111.069 174.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -110.38 109.26 19.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.254 0.622 . . . . 0.0 109.534 -170.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.28 146.29 39.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.626 0.77 . . . . 0.0 109.248 -178.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.551 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 4.3 t -64.35 108.49 1.63 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.635 0.774 . . . . 0.0 110.177 171.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -67.37 4.78 0.9 Allowed 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.551 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 36.6 mm -95.23 -54.73 6.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.441 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.6 p -120.47 -110.94 0.34 Allowed 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . 0.527 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.23 164.33 28.66 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 108.798 -1.721 . . . . 0.0 108.798 156.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.4 t80 171.24 110.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 102.449 -3.167 . . . . 0.0 102.449 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.65 132.44 56.68 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.79 0.805 . . . . 0.0 109.446 -164.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.1 t -152.54 166.19 32.79 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.317 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -100.37 -6.74 25.3 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.071 0.549 . . . . 0.0 110.37 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.562 HE21 ' HB1' ' A' ' 55' ' ' ALA . 51.9 tt0 -113.21 112.3 23.53 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.396 1.078 . . . . 0.0 109.249 -175.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -51.95 -38.01 54.97 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.691 0.797 . . . . 0.0 112.537 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ALA . . . . . 0.562 ' HB1' HE21 ' A' ' 53' ' ' GLN . . . -59.64 -39.06 83.08 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.979 0.799 . . . . 0.0 112.364 -178.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -59.28 -54.98 40.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.293 0.637 . . . . 0.0 111.395 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LEU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.6 OUTLIER -76.58 -29.5 56.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.057 0.543 . . . . 0.0 112.183 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.82 -37.18 63.31 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.583 0.753 . . . . 0.0 112.781 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' TRP . . . . . 0.445 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 95.7 m95 -80.55 -47.34 14.34 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 72.7 t60 -45.45 -42.49 10.55 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' MET . . . . . 0.481 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 26.0 ptm -67.2 -38.74 85.85 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 118.524 0.602 . . . . 0.0 112.4 174.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -63.33 -30.47 71.6 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.309 0.644 . . . . 0.0 111.3 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 95.4 mttt -66.6 -28.6 68.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.258 0.623 . . . . 0.0 111.253 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' HIS . . . . . 0.481 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 76.6 m-70 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 123.395 0.678 . . . . 0.0 111.166 174.824 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.327 0.584 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.5 t -97.71 116.26 29.59 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 167.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -64.96 -19.54 66.02 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.307 0.503 . . . . 0.0 111.763 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.62 -40.03 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.233 0.613 . . . . 0.0 111.683 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -141.08 -0.88 1.42 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.54 40.65 98.08 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 114.444 0.538 . . . . 0.0 114.444 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LYS . . . . . 0.406 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 5.9 tmtt? -66.36 -28.98 69.07 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 123.401 0.68 . . . . 0.0 112.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt 71.42 110.53 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 125.316 1.446 . . . . 0.0 111.037 172.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' PHE . . . . . 0.406 ' CE2' ' HB3' ' A' ' 79' ' ' LYS . 97.1 m-85 -120.38 164.64 16.05 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -172.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -67.99 -35.55 78.53 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 114.649 -1.159 . . . . 0.0 113.027 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.87 170.54 19.57 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 117.93 0.332 . . . . 0.0 111.633 175.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -57.47 -40.0 77.6 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.839 1.255 . . . . 0.0 110.913 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.35 -44.47 72.19 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 123.571 0.545 . . . . 0.0 111.228 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.5 m -63.78 -34.84 78.81 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.513 0.508 . . . . 0.0 111.742 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.79 -41.49 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.424 0.69 . . . . 0.0 110.251 -175.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 89.1 t -72.42 -38.6 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.877 1.271 . . . . 0.0 109.038 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.2 96.67 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.139 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -71.9 -31.56 66.53 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.952 -178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.88 -45.23 62.04 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.21 -33.19 74.09 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.013 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -92.38 -47.63 7.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.533 0.733 . . . . 0.0 111.528 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.94 -7.46 21.47 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.616 0.766 . . . . 0.0 111.918 -168.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 . . . . . 0 CA--C 1.567 1.632 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 177.609 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.6 m80 . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 74.7 mtm -138.67 -55.16 0.62 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.959 0.904 . . . . 0.0 109.131 171.758 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -102.31 30.8 4.34 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.791 0.805 . . . . 0.0 109.429 176.234 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -121.09 81.24 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-N 114.7 -1.137 . . . . 0.0 108.521 -173.021 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -78.64 110.23 13.57 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.962 -174.457 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.7 mm -109.19 131.78 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.774 0.83 . . . . 0.0 109.179 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.735 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 36.2 t -90.13 52.81 2.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.394 1.077 . . . . 0.0 109.025 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 56.76 -53.12 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 126.988 2.115 . . . . 0.0 115.48 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -134.44 -45.23 0.76 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.017 1.327 . . . . 0.0 109.817 -166.692 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.5 p -107.2 37.39 2.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.529 -167.899 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.735 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -142.68 122.93 13.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.193 0.597 . . . . 0.0 109.416 160.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -67.13 -55.65 13.3 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.413 1.071 . . . . 0.0 109.996 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.55 130.06 0.55 Allowed 'General case' 0 C--N 1.355 0.831 0 C-N-CA 124.036 0.934 . . . . 0.0 109.621 161.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -110.48 154.9 23.0 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.599 ' HZ1' ' HB3' ' A' ' 24' ' ' LYS . 0.2 OUTLIER -100.0 5.58 45.12 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.055 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -152.14 139.92 19.91 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.311 0.645 . . . . 0.0 109.55 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.456 ' HA ' HD22 ' A' ' 29' ' ' LEU . 32.3 t -52.56 -38.9 60.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.599 1.16 . . . . 0.0 111.958 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.479 ' O ' HG23 ' A' ' 31' ' ' VAL . 29.6 t-80 -69.84 -39.22 76.56 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.67 0.388 . . . . 0.0 111.345 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -56.86 -47.84 79.46 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.592 0.71 . . . . 0.0 110.911 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.67 HD13 HH11 ' A' ' 33' ' ' ARG . 0.2 OUTLIER -63.99 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.582 175.376 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.42 -27.86 68.84 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.866 0.866 . . . . 0.0 112.162 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.585 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 70.9 t -61.11 -45.2 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 124.039 0.935 . . . . 0.0 110.666 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.26 -36.65 74.59 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.967 0.507 . . . . 0.0 110.438 173.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.67 HH11 HD13 ' A' ' 29' ' ' LEU . 13.4 ttt180 -68.76 6.82 0.77 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.308 1.043 . . . . 0.0 112.608 -170.164 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptm -45.91 -15.67 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 125.901 1.681 . . . . 0.0 114.743 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.08 -54.32 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.309 0 C-N-CA 124.941 1.297 . . . . 0.0 109.05 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.513 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -107.3 2.03 24.25 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 -173.666 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 13.0 t -82.29 -41.43 20.16 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 120.058 1.299 . . . . 0.0 113.81 -165.118 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.04 -31.26 8.76 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.155 0.422 . . . . 0.0 114.155 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 2.2 mp0 -84.37 -51.26 7.1 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 117.231 0.516 . . . . 0.0 110.226 179.556 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 67.17 99.8 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.693 1.597 . . . . 0.0 111.546 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.585 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 73.9 Cg_endo -69.87 -147.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.985 2.457 . . . . 0.0 111.905 170.582 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.0 mt -129.32 116.95 19.86 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.739 -0.6 . . . . 0.0 111.726 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -108.98 142.74 39.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.953 0.901 . . . . 0.0 109.334 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.473 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 13.5 t -64.49 112.18 3.02 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 124.702 1.201 . . . . 0.0 109.689 170.058 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -79.52 29.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.0 1.32 . . . . 0.0 111.77 -174.093 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.473 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 2.8 mp -119.95 -16.0 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 124.494 1.118 . . . . 0.0 108.759 -173.808 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 1.4 p -175.97 -134.29 0.01 OUTLIER 'General case' 0 C--O 1.245 0.852 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 -156.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.552 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.94 131.48 4.14 Favored Glycine 0 C--N 1.309 -0.95 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 169.76 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 39.5 t80 176.9 113.37 0.03 OUTLIER 'General case' 0 C--N 1.349 0.573 0 N-CA-C 101.954 -3.35 . . . . 0.0 101.954 -175.248 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.0 m -128.73 139.99 51.95 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -166.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.526 ' SG ' ' HB3' ' A' ' 57' ' ' LEU . 19.3 p -153.78 166.06 34.06 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.166 -174.346 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -88.88 -31.07 18.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.264 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 138.0 38.63 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.699 0.8 . . . . 0.0 109.121 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -36.05 82.59 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -174.094 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.39 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -55.49 -47.91 75.42 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 -173.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.526 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 2.0 pt? -76.41 -37.44 57.07 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.487 0.585 . . . . 0.0 111.044 173.922 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.407 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 7.1 t30 -52.8 -44.61 66.74 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.808 0.843 . . . . 0.0 113.034 -176.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.419 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 100.0 m95 -80.9 -36.92 30.55 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.74 -177.231 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.406 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 58.5 t60 -53.84 -33.33 55.93 Favored 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 165.82 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.432 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 68.2 mtm -72.82 -37.86 67.35 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.449 0.568 . . . . 0.0 110.425 174.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -59.01 -34.16 71.55 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.808 0.843 . . . . 0.0 111.281 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.477 ' HA ' ' HB2' ' A' ' 68' ' ' SER . 33.8 mmtp -56.87 -28.78 62.22 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.641 172.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -89.6 -24.3 21.73 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.67 0.388 . . . . 0.0 110.745 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.8 t70 -53.08 -64.63 0.76 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.462 1.101 . . . . 0.0 111.647 -162.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.577 ' HA ' HG12 ' A' ' 87' ' ' VAL . . . -110.79 16.08 21.54 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.471 -1.241 . . . . 0.0 109.422 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.503 ' HB2' ' HB2' ' A' ' 73' ' ' SER . 30.2 t0 57.76 71.68 0.56 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.935 1.694 . . . . 0.0 112.551 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.477 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 75.7 m -80.64 -9.15 59.8 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.154 -1.385 . . . . 0.0 110.985 166.49 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -74.35 -40.54 62.07 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.907 0.883 . . . . 0.0 109.418 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -125.54 -96.98 0.43 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.23 -82.67 0.64 Allowed 'General case' 0 C--N 1.357 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.643 -173.914 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -155.06 129.04 8.76 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.503 ' HB2' ' HB2' ' A' ' 67' ' ' ASP . 20.0 m -159.51 165.46 32.95 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.492 1.517 . . . . 0.0 108.423 177.127 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -95.3 124.64 39.44 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 167.065 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -54.11 -39.29 66.26 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.296 0.569 . . . . 0.0 111.692 176.57 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 mt -86.12 -47.49 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.5 -166.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 20.3 p -126.99 3.42 6.53 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 119.319 0.963 . . . . 0.0 112.697 -175.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 52.61 37.87 51.21 Favored Glycine 0 C--N 1.361 1.972 0 N-CA-C 114.783 0.673 . . . . 0.0 114.783 174.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -30.29 71.4 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 122.83 0.452 . . . . 0.0 111.276 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt 75.11 122.34 0.04 OUTLIER 'General case' 0 C--N 1.36 1.045 0 C-N-CA 125.04 1.336 . . . . 0.0 109.587 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -130.86 162.91 28.58 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.551 0.741 . . . . 0.0 111.717 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.75 -44.46 96.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.399 1.08 . . . . 0.0 111.855 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.471 ' HG3' ' HB2' ' A' ' 85' ' ' ASP . 5.5 ptmm? -140.99 156.33 46.06 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.353 0.661 . . . . 0.0 109.729 -173.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -60.85 -31.56 70.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.328 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.471 ' HB2' ' HG3' ' A' ' 83' ' ' LYS . 8.3 m-20 -56.32 -43.05 78.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.528 0.731 . . . . 0.0 111.688 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.4 m -64.54 -31.56 72.82 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.033 0.533 . . . . 0.0 111.389 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . 0.577 HG12 ' HA ' ' A' ' 66' ' ' ALA . 41.8 t -75.66 -46.14 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.153 0.501 . . . . 0.0 110.479 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 75.9 t -70.92 -38.04 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.15 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.88 90.76 Favored 'General case' 0 C--N 1.349 0.551 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.582 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -70.26 -37.61 74.95 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.881 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.81 -38.45 67.18 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.456 0.702 . . . . 0.0 109.787 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.83 -23.08 65.99 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.983 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -102.75 -49.29 3.85 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.6 t -88.48 -6.93 57.32 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.229 1.011 . . . . 0.0 111.607 -170.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -137.3 67.05 53.59 Favored Pre-proline 0 N--CA 1.478 0.952 0 C-N-CA 122.797 0.439 . . . . 0.0 110.2 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.37 -37.33 5.82 Favored 'Trans proline' 0 C--N 1.378 2.1 0 C-N-CA 121.935 1.756 . . . . 0.0 110.665 169.087 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -131.35 99.89 4.99 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.567 1.626 0 C-N-CA 124.257 1.023 . . . . 0.0 111.918 177.815 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 91.4 m-70 . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.48 ' SD ' ' N ' ' A' ' 11' ' ' MET . 1.0 OUTLIER -93.85 -39.65 10.59 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.464 1.106 . . . . 0.0 109.799 -177.888 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -108.37 23.67 14.16 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.439 1.095 . . . . 0.0 110.514 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -144.64 100.21 3.48 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -172.876 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -86.64 104.48 16.1 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.454 HG21 ' HB2' ' A' ' 20' ' ' ALA . 29.4 mm -111.12 133.12 57.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 -173.739 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.469 ' HA ' HD12 ' A' ' 29' ' ' LEU . 41.8 t -54.96 -53.0 61.28 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.853 0.861 . . . . 0.0 110.865 174.997 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 172.15 -53.75 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.972 1.309 . . . . 0.0 108.711 177.377 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -140.59 -45.69 0.41 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -175.361 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 p -88.03 64.64 7.88 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.581 -1.645 . . . . 0.0 109.703 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.454 ' HB2' HG21 ' A' ' 15' ' ' ILE . . . -157.7 134.0 9.59 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.063 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -81.16 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 166.363 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.41 124.86 1.46 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.653 0.781 . . . . 0.0 108.986 165.085 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.441 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 96.7 m-85 -102.34 150.59 23.18 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.64 0.776 . . . . 0.0 109.414 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -76.19 -17.24 59.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.847 0.459 . . . . 0.0 112.167 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -146.88 150.36 35.07 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.054 0.541 . . . . 0.0 110.701 -174.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.405 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 66.5 p -58.73 -34.21 71.09 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.408 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -74.02 -35.49 64.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.763 0.825 . . . . 0.0 110.955 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.441 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -60.62 -48.41 81.89 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.623 0.769 . . . . 0.0 109.906 174.734 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.469 HD12 ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -66.6 -35.07 79.3 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.619 177.136 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.14 68.04 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.29 0.994 . . . . 0.0 111.88 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -56.62 -49.99 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 124.199 1.0 . . . . 0.0 111.411 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -34.9 65.99 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.398 0.618 . . . . 0.0 109.559 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.534 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 63.6 ttt180 -63.73 -7.76 8.55 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.682 -175.442 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptm -43.97 -15.19 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.25 -50.42 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.675 0 C-N-CA 124.559 1.143 . . . . 0.0 109.762 175.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.61 10.58 38.65 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 125.009 1.323 . . . . 0.0 112.36 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 9.0 t -55.91 -67.41 0.29 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -155.104 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . 0.415 ' H ' HG23 ' A' ' 37' ' ' THR . . . 69.81 36.56 74.63 Favored Glycine 0 N--CA 1.473 1.147 0 CA-C-N 118.644 0.656 . . . . 0.0 112.383 -176.712 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -169.74 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.302 1.441 . . . . 0.0 108.181 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 66.53 97.92 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.166 1.386 . . . . 0.0 113.555 164.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.51 164.33 26.22 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.099 1.866 . . . . 0.0 110.046 160.645 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.93 121.32 42.88 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.574 0.75 . . . . 0.0 109.17 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -109.57 143.53 39.14 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -174.222 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.401 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 14.5 t -69.57 109.68 4.42 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.725 0.81 . . . . 0.0 109.375 176.633 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 40.63 0.96 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.779 0.832 . . . . 0.0 110.428 -178.012 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.401 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.7 mp -130.97 -12.78 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 C-N-CA 124.945 1.298 . . . . 0.0 108.356 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.554 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 4.8 p -175.57 -124.33 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 N-CA-C 102.693 -3.077 . . . . 0.0 102.693 -167.213 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.554 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.95 134.69 4.95 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 117.251 -1.86 . . . . 0.0 108.638 163.733 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.8 t80 177.57 115.95 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 102.538 -3.134 . . . . 0.0 102.538 -176.441 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 m -110.48 146.19 36.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.504 0.669 . . . . 0.0 109.724 -171.027 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.566 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 43.6 t -144.83 -170.95 3.52 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 125.675 1.59 . . . . 0.0 107.886 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.415 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 14.5 ptm180 -131.94 -19.96 2.54 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.694 0.798 . . . . 0.0 110.717 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.596 HE22 ' HB2' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -102.26 125.06 48.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.173 0.989 . . . . 0.0 108.353 -179.329 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -52.9 -56.08 18.57 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.472 1.109 . . . . 0.0 113.266 -172.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.596 ' HB2' HE22 ' A' ' 53' ' ' GLN . . . -53.71 -39.66 65.4 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.048 0.539 . . . . 0.0 112.193 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.566 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 23.5 t -54.75 -55.74 26.71 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.429 ' H ' HD22 ' A' ' 57' ' ' LEU . 2.0 pt? -74.07 -26.31 60.32 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.042 0.383 . . . . 0.0 110.866 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.449 ' O ' ' HG2' ' A' ' 61' ' ' MET . 6.0 t30 -62.88 -25.11 68.14 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.609 0.764 . . . . 0.0 112.126 169.747 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.2 m95 -82.62 -39.1 22.63 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.544 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 63.1 t60 -58.33 -31.12 67.25 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 169.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.449 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 26.2 ptm -71.7 -31.44 66.75 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 119.496 1.044 . . . . 0.0 110.329 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -61.29 -32.67 72.52 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.126 0.571 . . . . 0.0 111.311 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.544 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 27.5 mmmt -62.66 -35.86 81.0 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.832 170.584 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -71.85 -25.6 62.03 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.244 0.617 . . . . 0.0 111.584 170.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -82.98 -15.12 52.49 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.9 -57.14 6.73 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.42 170.242 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 75.99 -36.01 0.27 Allowed 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 125.385 1.474 . . . . 0.0 112.849 174.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 34.0 t -62.78 -13.74 36.84 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.086 1.354 . . . . 0.0 113.55 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -57.57 -45.84 84.72 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.047 0.539 . . . . 0.0 111.158 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 40.94 69.75 0.31 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.896 1.372 . . . . 0.0 110.88 -169.803 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.13 -36.12 74.66 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.935 -166.839 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -120.05 160.34 23.0 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 124.45 1.1 . . . . 0.0 109.675 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.593 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 13.3 p -145.14 165.39 28.44 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 125.079 1.352 . . . . 0.0 109.498 178.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.8 t -109.55 115.35 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.944 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -67.75 -14.64 63.12 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.469 HD13 ' HE3' ' A' ' 91' ' ' LYS . 2.6 mt -90.06 -38.6 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.423 0.689 . . . . 0.0 112.078 -174.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -137.76 -1.72 2.0 Allowed 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.59 38.78 93.58 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 113.895 0.318 . . . . 0.0 113.895 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -40.47 92.07 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 122.923 0.489 . . . . 0.0 111.672 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.593 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 14.0 mptt 72.54 116.81 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.947 1.299 . . . . 0.0 111.034 -177.327 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -125.1 163.67 21.89 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.854 0.862 . . . . 0.0 111.176 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -73.66 -44.85 55.67 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.741 0.816 . . . . 0.0 112.419 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -145.7 163.4 35.02 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.727 0.411 . . . . 0.0 111.793 -167.635 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -49.67 -39.35 36.21 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 125.488 1.515 . . . . 0.0 112.062 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.91 -46.25 67.93 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.458 1.099 . . . . 0.0 111.154 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -71.98 -35.75 69.6 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.517 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -75.28 -51.04 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 123.963 0.905 . . . . 0.0 111.345 -170.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.01 -34.38 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.257 -172.396 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.92 88.57 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.304 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.18 -33.7 67.88 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.998 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.469 ' HE3' HD13 ' A' ' 76' ' ' ILE . 87.2 tttt -73.12 -44.36 60.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.322 0.582 . . . . 0.0 110.171 -178.622 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.76 -22.54 67.01 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.768 -1.105 . . . . 0.0 112.174 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -106.35 -50.19 3.2 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.1 t -90.66 -9.3 47.38 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.52 0.728 . . . . 0.0 111.49 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.8 m-70 -139.08 62.74 27.38 Favored Pre-proline 0 N--CA 1.484 1.266 0 C-N-CA 123.295 0.638 . . . . 0.0 110.634 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -66.43 -25.57 48.49 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.577 2.185 . . . . 0.0 111.634 174.96 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -123.77 95.47 4.58 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.67 1.188 . . . . 0.0 108.026 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 CA--C 1.558 1.257 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.583 178.326 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.4 m80 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.777 0.322 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.486 ' HA ' ' HE2' ' A' ' 11' ' ' MET . 8.7 mmt -128.19 -54.03 1.28 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.315 1.446 . . . . 0.0 108.907 175.104 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -126.72 55.4 1.54 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -129.25 83.27 2.13 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -170.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -97.8 120.89 39.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.573 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.583 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -118.42 157.87 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.067 0.947 . . . . 0.0 109.147 -164.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.632 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 46.9 t -96.74 -12.37 23.82 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.186 0.594 . . . . 0.0 110.744 176.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.583 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.5 tt0 97.59 -20.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 126.513 1.925 . . . . 0.0 111.065 167.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -135.9 -51.5 0.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.871 0.843 . . . . 0.0 109.138 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.9 p -121.17 72.67 1.0 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.464 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.632 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -168.03 145.74 4.32 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.966 0.889 . . . . 0.0 112.694 163.09 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.13 -168.23 1.05 Allowed 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 113.318 -1.764 . . . . 0.0 109.377 162.577 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.75 125.44 30.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.19 0.596 . . . . 0.0 109.823 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.593 ' HE1' ' HB3' ' A' ' 20' ' ' ALA . 77.1 m-85 -111.53 148.88 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.742 0.817 . . . . 0.0 109.044 174.634 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -61.98 -30.17 70.76 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.091 0.556 . . . . 0.0 111.669 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 53.1 m -144.85 151.06 38.18 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.32 0.648 . . . . 0.0 110.83 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.512 ' HA ' HD21 ' A' ' 29' ' ' LEU . 34.4 t -57.55 -37.11 72.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.871 0.868 . . . . 0.0 111.462 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 -69.54 -35.25 75.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.028 0.931 . . . . 0.0 111.98 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.92 -45.88 91.77 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.462 0.648 . . . . 0.0 110.643 174.681 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.512 HD21 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -68.36 -29.54 68.28 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.676 174.274 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.75 -26.31 68.63 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.349 0.66 . . . . 0.0 111.568 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 64.1 t -61.84 -47.64 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 122.845 0.458 . . . . 0.0 110.241 171.426 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -62.32 -38.4 89.29 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.732 0.813 . . . . 0.0 110.407 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -65.29 2.37 0.86 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.733 1.213 . . . . 0.0 112.214 -175.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.1 ptp -44.81 -19.48 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 125.209 1.404 . . . . 0.0 113.425 171.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.9 tp -86.52 -51.02 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 125.538 1.535 . . . . 0.0 110.572 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.87 5.33 40.93 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 123.451 0.7 . . . . 0.0 112.235 -173.465 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.7 t -59.32 -57.33 13.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -164.084 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.67 -31.66 2.18 Favored Glycine 0 CA--C 1.538 1.53 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 -169.191 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.43 -45.82 57.87 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 109.91 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt 66.42 98.3 0.04 OUTLIER Pre-proline 0 C--N 1.357 0.932 0 O-C-N 124.918 1.386 . . . . 0.0 111.072 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -70.68 -170.89 0.49 Allowed 'Trans proline' 0 C--N 1.382 2.339 0 C-N-CA 122.899 2.399 . . . . 0.0 111.391 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.478 HD12 ' HB3' ' A' ' 54' ' ' LYS . 39.8 mt -99.02 119.37 37.67 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -172.013 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 50.7 tt0 -135.45 144.38 46.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 122.716 0.407 . . . . 0.0 111.542 -171.841 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.457 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 6.6 t -64.93 107.7 1.56 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.174 0.989 . . . . 0.0 110.684 174.665 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.62 14.58 1.25 Allowed 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.175 0.99 . . . . 0.0 112.551 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.457 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 32.3 mm -96.53 -53.66 7.88 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 20.1 p -119.65 -107.15 0.37 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.772 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.517 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.5 166.82 29.68 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 156.05 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 74.5 t80 168.45 111.26 0.01 OUTLIER 'General case' 0 C--N 1.346 0.452 0 N-CA-C 102.185 -3.265 . . . . 0.0 102.185 175.789 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -115.05 132.93 56.44 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.559 0.695 . . . . 0.0 109.214 -169.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.6 t -149.43 175.28 11.61 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.971 -1.468 . . . . 0.0 109.024 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.6 ppt_? -103.41 3.25 34.88 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.907 0.883 . . . . 0.0 110.891 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -127.9 103.74 7.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.046 0.938 . . . . 0.0 108.645 -174.281 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.478 ' HB3' HD12 ' A' ' 42' ' ' LEU . 21.0 ptmt -58.6 -28.83 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.568 0.747 . . . . 0.0 112.57 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.19 -39.79 70.01 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.926 0.89 . . . . 0.0 111.829 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.4 t -63.22 -54.64 34.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.768 0.827 . . . . 0.0 111.172 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.535 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -74.29 -27.67 60.83 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.98 0.512 . . . . 0.0 112.224 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.432 ' O ' ' HG2' ' A' ' 61' ' ' MET . 44.3 t30 -51.48 -51.66 53.16 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.603 0.761 . . . . 0.0 112.17 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -81.75 -32.41 31.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.564 0.221 . . . . 0.0 111.028 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.535 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 76.0 t60 -48.97 -42.43 37.65 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 163.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.499 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 17.2 ptm -70.99 -31.87 68.53 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 119.617 1.099 . . . . 0.0 111.604 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.253 0.621 . . . . 0.0 111.351 170.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.437 ' HB3' ' HB2' ' A' ' 69' ' ' PHE . 48.0 mmtm -63.12 -36.51 83.84 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.624 0.369 . . . . 0.0 110.58 172.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.499 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.6 m-70 -78.56 -33.08 48.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.556 0.742 . . . . 0.0 109.86 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 35.5 t70 -84.28 -23.47 30.33 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.663 -170.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . 0.567 ' HA ' ' HA ' ' A' ' 75' ' ' ASN . . . -108.07 -0.25 21.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.975 0.91 . . . . 0.0 111.653 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.4 ' HB2' ' HB3' ' A' ' 73' ' ' SER . 5.7 m-20 57.57 17.71 4.14 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 124.022 0.929 . . . . 0.0 112.26 -174.355 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.2 m -78.21 -11.13 59.9 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.303 1.041 . . . . 0.0 111.412 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.437 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 48.2 t80 -71.33 -41.14 70.21 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.016 0.526 . . . . 0.0 109.699 177.452 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -79.3 -86.53 0.07 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.057 0.543 . . . . 0.0 110.037 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -112.33 -95.33 0.44 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.645 0.657 . . . . 0.0 109.944 177.375 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -153.88 132.46 12.16 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 -172.05 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.4 ' HB3' ' HB2' ' A' ' 67' ' ' ASP . 33.4 t -158.22 165.13 35.63 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.349 0.66 . . . . 0.0 110.556 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.1 t -90.14 125.04 35.31 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 172.337 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . 0.567 ' HA ' ' HA ' ' A' ' 66' ' ' ALA . 2.8 t-20 -52.87 -30.68 35.26 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.815 0.846 . . . . 0.0 113.153 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -103.79 -30.92 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -163.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.435 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 18.8 p -136.85 -0.31 2.33 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.863 0.756 . . . . 0.0 112.099 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 59.56 34.35 81.04 Favored Glycine 0 C--N 1.358 1.779 0 N-CA-C 114.301 0.48 . . . . 0.0 114.301 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.435 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.6 tmtt? -63.37 -30.62 71.72 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.462 1.105 . . . . 0.0 112.442 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm 74.13 116.69 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.742 1.217 . . . . 0.0 111.28 175.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -131.32 159.37 38.08 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.693 0.797 . . . . 0.0 110.269 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.34 -31.18 67.07 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.422 0.689 . . . . 0.0 111.729 -177.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.2 ptpt -134.04 148.06 51.02 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.637 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.55 -35.56 68.27 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.916 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.98 -45.96 71.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.149 0.979 . . . . 0.0 111.132 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 19.9 t -69.32 -28.36 66.18 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.043 0.537 . . . . 0.0 110.839 -176.919 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 87.0 t -70.57 -46.77 68.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.019 0.928 . . . . 0.0 109.967 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.1 t -71.93 -36.22 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.819 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.36 79.48 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.622 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -70.9 -34.55 71.68 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.529 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -38.53 71.1 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.089 0.956 . . . . 0.0 109.351 -174.438 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.51 -18.13 63.65 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.778 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -96.51 -49.78 5.0 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.422 0.689 . . . . 0.0 110.792 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.0 t -82.79 -32.31 27.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.255 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.413 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 13.7 m-70 -136.16 54.51 9.8 Favored Pre-proline 0 CA--C 1.573 1.85 0 C-N-CA 122.761 0.424 . . . . 0.0 111.505 -171.702 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.413 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 24.2 Cg_exo -63.5 -36.52 53.81 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 122.038 1.825 . . . . 0.0 111.381 170.475 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -115.92 97.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.941 1.296 . . . . 0.0 107.634 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 C--O 1.253 1.25 0 C-N-CA 124.471 1.108 . . . . 0.0 109.128 176.793 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 . . . . . 0 CA--C 1.557 1.247 0 N-CA-C 111.105 0.039 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.8 ptp -165.44 -41.12 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.978 0.511 . . . . 0.0 112.261 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.95 69.88 1.36 Allowed 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.413 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 3.2 p-10 -172.95 103.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.676 -172.507 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -84.76 124.85 32.01 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.334 0.654 . . . . 0.0 110.74 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.492 HG21 ' H ' ' A' ' 17' ' ' GLU . 5.3 mm -115.03 150.77 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 -172.633 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.614 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 t -83.97 -19.1 35.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.2 0.6 . . . . 0.0 109.492 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.492 ' H ' HG21 ' A' ' 15' ' ' ILE . 32.4 tt0 77.06 0.37 3.05 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.787 1.635 . . . . 0.0 110.701 173.635 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -136.16 -50.48 0.69 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.107 0.963 . . . . 0.0 108.612 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.36 77.05 1.53 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.56 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.614 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.52 137.37 2.26 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.942 0.897 . . . . 0.0 110.948 167.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 ptt180 -70.3 -77.95 0.08 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.337 168.485 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.413 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . -163.44 149.42 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.449 0.7 . . . . 0.0 110.233 171.087 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -126.83 152.63 46.73 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.379 0.671 . . . . 0.0 110.258 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -61.76 -32.62 72.89 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.63 0.772 . . . . 0.0 112.357 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -147.63 160.04 43.1 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.887 0.375 . . . . 0.0 111.118 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 p -56.68 -35.67 68.73 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.259 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -75.9 -35.55 59.77 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.0 0.92 . . . . 0.0 112.501 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -50.41 69.88 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.158 0.98 . . . . 0.0 109.041 169.602 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -60.02 -40.2 88.46 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 113.767 -1.56 . . . . 0.0 112.523 172.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.592 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -56.47 -26.9 55.54 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.617 0.767 . . . . 0.0 112.571 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.429 HG11 HG21 ' A' ' 50' ' ' THR . 85.5 t -60.35 -44.96 97.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 123.862 0.865 . . . . 0.0 110.681 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -72.15 -45.98 58.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.523 0.729 . . . . 0.0 110.769 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.592 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 29.8 ttt180 -63.39 -5.13 3.23 Favored 'General case' 0 C--O 1.212 -0.92 0 C-N-CA 125.779 1.632 . . . . 0.0 111.467 -174.844 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.5 ptm -47.44 -12.91 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 125.338 1.455 . . . . 0.0 114.69 173.923 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -83.99 -52.57 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.579 0 C-N-CA 124.715 1.206 . . . . 0.0 109.431 173.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -104.7 1.41 29.35 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.659 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.7 t -70.74 -49.61 45.04 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -165.003 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.94 -30.55 3.55 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-O 120.01 -0.328 . . . . 0.0 112.403 -164.526 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -103.8 76.87 1.41 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 124.713 1.205 . . . . 0.0 108.444 175.027 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -52.79 131.56 47.59 Favored Pre-proline 0 CA--C 1.558 1.272 0 C-N-CA 123.333 0.653 . . . . 0.0 111.969 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.85 -172.87 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.568 2.179 . . . . 0.0 111.238 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.4 mt -103.06 99.36 9.24 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.51 134.15 55.31 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -166.751 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.403 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 23.2 t -74.66 106.65 6.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.896 0.878 . . . . 0.0 110.189 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.11 42.26 1.02 Allowed 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.164 0.983 . . . . 0.0 110.493 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.3 mp -127.78 -2.28 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.563 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 6.6 p 173.71 -136.79 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 -168.547 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.503 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -144.39 127.07 2.84 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.889 -2.084 . . . . 0.0 107.889 171.184 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.9 t80 179.7 112.02 0.04 OUTLIER 'General case' 0 C--O 1.237 0.434 0 N-CA-C 102.147 -3.279 . . . . 0.0 102.147 -167.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.429 HG21 HG11 ' A' ' 31' ' ' VAL . 2.9 m -123.56 144.96 49.24 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.612 0.72 . . . . 0.0 109.804 -170.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 81.6 m -147.26 171.16 15.84 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.696 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.456 ' HD2' ' H ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -117.42 -7.2 11.18 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.887 170.198 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -102.83 111.77 24.26 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 169.128 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -58.32 -33.88 69.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.604 0.761 . . . . 0.0 111.277 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.64 -42.82 71.72 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 124.456 1.098 . . . . 0.0 112.413 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -55.27 -53.78 51.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.967 0.907 . . . . 0.0 112.442 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.559 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 1.1 pt? -75.86 -27.39 57.78 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.066 0.547 . . . . 0.0 111.567 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.566 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 67.0 t30 -55.1 -44.76 75.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.783 0.833 . . . . 0.0 113.208 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.483 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 66.0 p-90 -82.52 -39.79 21.9 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 122.03 -0.419 . . . . 0.0 110.345 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.559 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 75.9 t60 -48.06 -35.25 10.9 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 171.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.566 ' HE2' ' HA ' ' A' ' 58' ' ' ASN . 23.7 ptp -70.03 -37.56 75.65 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 119.174 0.897 . . . . 0.0 111.043 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.483 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 19.4 ttmm -56.93 -37.11 71.04 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.872 0.869 . . . . 0.0 110.699 172.117 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -61.3 -31.39 71.23 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.654 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -73.89 -13.26 60.88 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.302 0.641 . . . . 0.0 111.706 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -103.74 -18.01 14.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -96.28 -29.22 14.12 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.031 0.932 . . . . 0.0 110.978 -171.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -82.97 -5.34 59.04 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.507 0.323 . . . . 0.0 111.231 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.408 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 35.5 p -80.73 -61.9 1.83 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.916 0.886 . . . . 0.0 110.35 -173.582 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 88.5 m-85 -125.45 -33.16 2.84 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.086 0.554 . . . . 0.0 111.379 177.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 70.4 t80 -59.69 -32.11 70.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.287 1.035 . . . . 0.0 112.466 -169.27 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -79.57 -81.68 0.11 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -154.76 137.34 15.13 Favored 'General case' 0 C--N 1.345 0.413 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 89.3 p -157.52 165.97 34.18 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.801 0.81 . . . . 0.0 111.133 178.529 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.66 117.4 30.04 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -67.41 -9.39 41.22 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.337 0.517 . . . . 0.0 112.299 -174.462 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.612 HD13 ' HE3' ' A' ' 91' ' ' LYS . 3.2 mt -96.69 -37.39 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.199 0.6 . . . . 0.0 111.905 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.9 p -139.64 8.79 2.39 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 54.0 42.8 71.69 Favored Glycine 0 C--N 1.344 1.019 0 C-N-CA 123.884 0.755 . . . . 0.0 114.885 173.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -66.52 -39.34 88.6 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.408 ' HE3' ' O ' ' A' ' 68' ' ' SER . 11.6 mptt 71.23 117.75 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 124.417 1.087 . . . . 0.0 109.853 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 87.6 m-85 -124.39 170.63 10.64 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.73 0.812 . . . . 0.0 110.148 177.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.51 ' HG3' ' HG2' ' A' ' 83' ' ' LYS . 13.7 pt-20 -64.29 -41.34 96.93 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.369 173.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.51 ' HG2' ' HG3' ' A' ' 82' ' ' GLU . 17.3 ptpt -142.27 157.64 44.6 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.318 0.647 . . . . 0.0 109.554 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -67.7 -21.99 65.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.64 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -60.13 -43.98 95.27 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.495 0.318 . . . . 0.0 110.76 171.565 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.2 m -66.07 -29.28 69.59 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.178 0.591 . . . . 0.0 111.449 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 65.3 t -71.37 -49.18 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.013 0.925 . . . . 0.0 110.272 -178.938 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 96.0 t -74.34 -33.01 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.838 1.255 . . . . 0.0 109.92 -174.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.85 89.02 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.802 173.671 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -73.96 -35.35 64.51 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.272 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.612 ' HE3' HD13 ' A' ' 76' ' ' ILE . 85.0 tttt -70.88 -46.7 62.14 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.44 1.096 . . . . 0.0 111.213 -169.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -20.75 66.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.684 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.2 mmtm -99.03 -47.62 5.17 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.117 0.567 . . . . 0.0 111.006 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.2 t -84.84 -20.25 31.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.018 0.927 . . . . 0.0 111.761 -170.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -136.89 65.59 53.12 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 122.975 0.51 . . . . 0.0 110.258 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -50.71 -39.03 57.26 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 123.255 2.637 . . . . 0.0 113.192 169.131 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -108.31 98.44 7.98 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.559 1.144 . . . . 0.0 108.835 -177.656 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.556 1.211 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.432 169.944 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.4 mtp -128.2 -54.18 1.28 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.078 0.951 . . . . 0.0 108.919 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -126.68 83.15 2.14 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.73 101.92 3.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -99.48 115.03 28.35 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.468 HG23 ' HB3' ' A' ' 20' ' ' ALA . 31.6 mm -119.36 134.18 63.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -170.553 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.8 t -57.69 -51.43 69.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.264 1.025 . . . . 0.0 110.711 172.895 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 166.14 -54.08 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 125.758 1.623 . . . . 0.0 109.367 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -137.46 -51.3 0.63 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.308 -169.083 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -90.78 61.39 4.74 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.112 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.468 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -153.94 128.64 9.38 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.02 169.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HB2' ' H ' ' A' ' 22' ' ' ALA . 44.4 mtp180 -69.79 -79.45 0.06 Allowed 'General case' 0 CA--C 1.55 0.942 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 169.788 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.411 ' H ' ' HB2' ' A' ' 21' ' ' ARG . . . -164.72 140.63 5.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.204 1.002 . . . . 0.0 108.613 163.473 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.25 145.12 43.39 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.678 0.791 . . . . 0.0 109.044 175.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -78.78 -9.36 59.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.857 0.463 . . . . 0.0 112.035 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -147.06 147.13 30.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.299 0.64 . . . . 0.0 110.77 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.4 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 22.6 t -62.09 -34.34 76.12 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.01 0.924 . . . . 0.0 111.844 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -73.25 -33.89 65.54 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 120.803 0.335 . . . . 0.0 110.36 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.79 -42.9 94.42 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.555 0.742 . . . . 0.0 111.127 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.4 ' HG ' ' O ' ' A' ' 26' ' ' SER . 0.3 OUTLIER -66.0 -34.46 78.14 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.969 175.105 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.18 -27.8 68.67 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 112.324 176.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.466 HG13 HG21 ' A' ' 50' ' ' THR . 79.1 t -63.02 -48.88 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.245 0.618 . . . . 0.0 110.976 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -62.56 -35.09 78.37 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.673 0.789 . . . . 0.0 109.943 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -66.22 4.34 0.72 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.975 1.31 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -46.79 -15.21 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 125.519 1.528 . . . . 0.0 114.622 170.524 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -49.88 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.638 0 C-N-CA 125.346 1.458 . . . . 0.0 110.212 173.812 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.0 -10.43 20.55 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -169.862 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.4 t -72.68 -42.05 64.68 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -161.536 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.12 -29.85 3.06 Favored Glycine 0 CA--C 1.541 1.693 0 CA-C-O 120.401 -0.11 . . . . 0.0 112.986 -165.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -107.79 77.78 1.15 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 125.174 1.389 . . . . 0.0 108.027 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -49.14 133.1 16.07 Favored Pre-proline 0 N--CA 1.491 1.58 0 C-N-CA 123.925 0.89 . . . . 0.0 112.06 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -70.88 -178.63 2.87 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.709 2.273 . . . . 0.0 111.516 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.411 HD11 ' N ' ' A' ' 42' ' ' LEU . 3.8 mp -102.03 90.04 3.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -170.373 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -121.65 142.92 49.66 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.532 0.733 . . . . 0.0 110.177 -172.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.516 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 40.8 t -69.85 108.1 3.83 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.527 1.131 . . . . 0.0 109.746 174.344 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.55 48.41 1.3 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 122.84 1.305 . . . . 0.0 108.492 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.516 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -126.53 -9.92 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 125.748 1.619 . . . . 0.0 108.049 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.571 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 5.8 p 179.61 -123.5 0.0 OUTLIER 'General case' 0 C--N 1.348 0.543 0 N-CA-C 102.758 -3.053 . . . . 0.0 102.758 -162.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.571 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.82 143.81 11.23 Favored Glycine 0 C--N 1.308 -1.001 0 CA-C-O 117.342 -1.81 . . . . 0.0 108.978 159.326 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.4 t80 177.38 112.36 0.03 OUTLIER 'General case' 0 C--N 1.361 1.093 0 N-CA-C 103.052 -2.944 . . . . 0.0 103.052 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.466 HG21 HG13 ' A' ' 31' ' ' VAL . 2.7 m -119.19 148.19 43.38 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 118.712 0.687 . . . . 0.0 109.733 -171.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 87.8 m -152.21 169.06 23.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.509 1.124 . . . . 0.0 110.256 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.1 ttt180 -84.41 -36.42 22.42 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.503 0.721 . . . . 0.0 110.002 170.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -92.67 130.13 38.39 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.462 0.705 . . . . 0.0 109.306 -173.873 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -61.63 -41.44 97.49 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.659 0.784 . . . . 0.0 110.399 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -43.18 65.9 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.72 0.808 . . . . 0.0 112.276 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.0 m -51.94 -53.41 41.44 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.705 0.802 . . . . 0.0 112.434 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.454 ' H ' HD22 ' A' ' 57' ' ' LEU . 1.3 pt? -77.14 -28.55 54.3 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.745 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -61.75 -30.91 71.09 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 118.495 0.588 . . . . 0.0 112.18 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -79.82 -49.47 11.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -49.29 -36.82 21.91 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.4 ' SD ' ' N ' ' A' ' 62' ' ' LYS . 3.6 ppp? -71.02 -35.44 72.02 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.509 1.05 . . . . 0.0 110.309 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.4 ' N ' ' SD ' ' A' ' 61' ' ' MET . 30.1 ttmt -67.06 -28.33 68.11 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.54 0.736 . . . . 0.0 111.462 172.001 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -61.98 -32.23 72.65 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.091 0.556 . . . . 0.0 112.021 170.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -75.02 -22.08 58.7 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 122.699 0.4 . . . . 0.0 111.558 170.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -95.63 -19.42 19.76 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.2 -23.5 47.51 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 124.702 1.201 . . . . 0.0 110.668 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.9 t70 64.36 53.98 1.61 Allowed 'General case' 0 C--N 1.361 1.101 0 O-C-N 124.443 1.09 . . . . 0.0 109.5 175.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 46.0 m -91.66 -66.56 0.92 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.295 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -116.57 6.72 13.5 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.842 0.857 . . . . 0.0 111.11 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.42 ' HD1' ' HZ1' ' A' ' 80' ' ' LYS . 61.1 m-85 -118.3 31.63 6.57 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -177.134 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -69.19 -32.79 72.33 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.793 -166.972 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -133.51 138.4 46.08 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 73.0 p -156.33 165.09 37.38 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 123.709 0.804 . . . . 0.0 110.694 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.538 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 43.9 t -95.77 116.24 28.6 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -60.96 -15.72 34.65 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 122.062 -0.399 . . . . 0.0 111.578 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 mt -97.2 -37.6 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.23 0.612 . . . . 0.0 109.818 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 77' ' ' CYS . 14.1 p -160.05 56.85 0.36 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 121.019 0.438 . . . . 0.0 110.893 -178.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.538 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -25.48 74.26 0.0 OUTLIER Glycine 0 N--CA 1.492 2.392 0 C-N-CA 127.205 2.336 . . . . 0.0 118.265 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -88.46 -8.76 54.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.061 0.944 . . . . 0.0 111.682 171.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.42 ' HZ1' ' HD1' ' A' ' 70' ' ' TYR . 1.3 mptm? 68.83 107.15 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.564 1.146 . . . . 0.0 110.298 173.691 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -110.59 168.05 9.76 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.044 0.538 . . . . 0.0 111.643 -172.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -59.66 -28.41 67.23 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.071 0.948 . . . . 0.0 112.297 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -163.66 161.72 23.79 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.351 0.661 . . . . 0.0 110.302 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.471 ' O ' HG23 ' A' ' 88' ' ' VAL . 25.0 pttm -65.8 -27.71 68.47 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.175 177.235 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -58.87 -39.68 82.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.575 0.75 . . . . 0.0 111.354 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.4 m -67.39 -31.72 72.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.234 0.613 . . . . 0.0 111.046 174.775 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.03 -40.91 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.732 0.813 . . . . 0.0 110.347 -177.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . 0.471 HG23 ' O ' ' A' ' 84' ' ' LYS . 58.4 t -73.13 -36.16 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.293 1.037 . . . . 0.0 109.225 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . 0.481 ' O ' ' HG2' ' A' ' 93' ' ' LYS . . . -65.63 -40.68 92.81 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.418 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -71.82 -33.93 68.91 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.633 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -70.37 -33.5 71.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.136 0.974 . . . . 0.0 108.77 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.79 74.33 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.18 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.481 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 29.2 mmtp -93.95 -48.49 6.23 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.962 0.41 . . . . 0.0 111.092 -172.13 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -90.34 -23.74 21.04 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.68 0.792 . . . . 0.0 111.239 -171.069 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.406 ' HB3' HG13 ' A' ' 98' ' ' VAL . 31.4 m-70 -132.81 47.42 2.72 Favored Pre-proline 0 CA--C 1.572 1.796 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.447 -173.779 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -67.31 -26.84 41.2 Favored 'Trans proline' 0 C--N 1.39 2.711 0 C-N-CA 121.861 1.707 . . . . 0.0 112.606 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -138.65 101.47 4.34 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.618 1.167 . . . . 0.0 107.892 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.406 HG13 ' HB3' ' A' ' 95' ' ' HIS . 2.8 p . . . . . 0 CA--C 1.562 1.407 0 C-N-CA 123.984 0.913 . . . . 0.0 109.468 173.481 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.6 p80 . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.4 ' SD ' ' HE1' ' A' ' 14' ' ' TYR . 17.8 tpt -71.09 78.39 0.67 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 172.881 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -164.68 93.57 0.65 Allowed 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.86 90.04 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.484 1.113 . . . . 0.0 111.692 172.336 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.4 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 64.9 m-85 -77.91 121.77 24.6 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.599 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.6 mm -112.81 117.18 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.139 -171.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.409 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 46.6 t -57.7 -23.65 52.78 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.527 1.131 . . . . 0.0 111.572 172.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 115.93 -24.84 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.53 0 C-N-CA 127.287 2.235 . . . . 0.0 111.18 164.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -133.81 -48.65 0.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.809 0.814 . . . . 0.0 109.091 -177.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.1 p -114.92 64.02 0.68 Allowed 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.209 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.409 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -162.98 112.86 1.38 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.176 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.45 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 7.3 ptm180 -68.29 -45.17 73.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 169.573 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.45 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -172.58 148.97 2.03 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 123.772 0.829 . . . . 0.0 110.971 157.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -118.1 148.04 42.69 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -65.65 -25.54 67.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.4 m -147.02 156.93 43.42 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.964 0.411 . . . . 0.0 111.827 -175.203 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.3 p -59.11 -37.24 76.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.537 170.277 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.402 ' O ' HG22 ' A' ' 31' ' ' VAL . 15.2 m-70 -69.37 -39.26 78.14 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.867 0.867 . . . . 0.0 109.95 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -60.21 -51.06 71.19 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.52 1.128 . . . . 0.0 110.623 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -33.54 75.94 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.86 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.96 69.91 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.962 0.905 . . . . 0.0 112.207 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.524 HG21 ' HE ' ' A' ' 52' ' ' ARG . 25.8 t -68.32 -40.21 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.433 0.458 . . . . 0.0 110.338 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.82 -39.27 69.92 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.542 0.737 . . . . 0.0 109.69 175.717 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -64.08 -6.47 6.48 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.22 1.408 . . . . 0.0 111.614 -176.359 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.517 ' SD ' ' HB ' ' A' ' 50' ' ' THR . 25.9 ptt? -46.94 -15.19 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -54.4 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 125.226 1.41 . . . . 0.0 109.406 176.677 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.96 5.12 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 123.799 0.84 . . . . 0.0 112.98 -175.046 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -62.39 -35.78 80.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.747 0.419 . . . . 0.0 112.085 -168.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.57 -25.24 3.96 Favored Glycine 0 C--N 1.35 1.33 0 O-C-N 123.019 0.199 . . . . 0.0 112.719 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -128.47 89.22 2.86 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -53.56 112.73 3.97 Favored Pre-proline 0 N--CA 1.49 1.554 0 C-N-CA 123.946 0.898 . . . . 0.0 110.651 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.02 -67.35 0.04 OUTLIER 'Trans proline' 0 C--N 1.385 2.459 0 C-N-CA 122.682 2.255 . . . . 0.0 112.124 -173.43 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.456 ' HB3' HD21 ' A' ' 57' ' ' LEU . 85.4 mt -145.67 96.52 2.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.395 1.078 . . . . 0.0 108.458 -176.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -132.52 143.06 49.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.372 0.669 . . . . 0.0 110.545 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.4 t -63.91 110.53 2.13 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.335 1.054 . . . . 0.0 110.311 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -84.92 29.73 0.62 Allowed 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 123.845 0.858 . . . . 0.0 111.487 -178.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.35 -56.49 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.497 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.7 p -113.71 -117.67 0.32 Allowed 'General case' 0 C--O 1.239 0.507 0 N-CA-C 102.447 -3.168 . . . . 0.0 102.447 166.912 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.497 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.96 163.74 28.29 Favored Glycine 0 C--N 1.313 -0.696 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 156.32 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.6 t80 172.33 112.55 0.01 OUTLIER 'General case' 0 C--O 1.24 0.566 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.517 ' HB ' ' SD ' ' A' ' 34' ' ' MET . 3.4 m -114.3 138.05 51.01 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -173.076 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -144.97 162.06 37.84 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.761 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.524 ' HE ' HG21 ' A' ' 31' ' ' VAL . 38.0 ttm180 -76.98 -31.61 56.65 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.575 175.828 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.453 HE21 ' HB2' ' A' ' 55' ' ' ALA . 53.5 tt0 -106.71 122.16 45.8 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.701 0.8 . . . . 0.0 109.685 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -49.43 -47.59 47.98 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.63 1.172 . . . . 0.0 111.974 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.453 ' HB2' HE21 ' A' ' 53' ' ' GLN . . . -53.44 -31.85 47.21 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.127 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -63.43 -56.04 19.4 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.676 0.39 . . . . 0.0 111.371 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.456 HD21 ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -75.06 -30.72 61.07 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.958 0.503 . . . . 0.0 111.646 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.02 -48.58 64.43 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.606 1.162 . . . . 0.0 112.776 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.442 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 8.8 m95 -77.06 -42.41 38.47 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.944 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.438 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 59.6 t60 -46.42 -41.36 13.63 Favored 'General case' 0 CA--C 1.569 1.678 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 168.708 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.501 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 75.0 mtm -71.41 -43.15 67.31 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 118.217 0.462 . . . . 0.0 111.562 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -60.31 -25.36 65.72 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 123.025 0.53 . . . . 0.0 111.855 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.442 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 32.6 mmmt -62.4 -38.59 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.924 0.49 . . . . 0.0 110.559 171.956 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.501 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 98.6 m-70 -65.17 -26.62 68.24 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 123.051 0.54 . . . . 0.0 111.085 172.154 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -90.15 -11.2 41.86 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.228 0.611 . . . . 0.0 109.776 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.2 -48.76 32.44 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 123.693 0.797 . . . . 0.0 109.141 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 73.28 -26.21 0.19 Allowed 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.668 1.187 . . . . 0.0 113.566 176.902 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.3 t -62.75 -9.98 11.19 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.713 1.205 . . . . 0.0 113.503 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -120.04 -21.73 6.96 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.98 0.912 . . . . 0.0 109.527 -176.201 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -111.06 -9.69 14.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.029 -169.224 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -118.93 8.73 11.74 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.697 -177.78 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -139.16 133.48 31.51 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -175.295 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.8 p -161.96 121.34 2.41 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.499 1.12 . . . . 0.0 109.148 -174.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.557 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 0.9 OUTLIER -72.16 135.56 46.2 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 167.062 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.5 -27.07 65.82 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.975 0.91 . . . . 0.0 113.409 -174.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -113.08 -38.55 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 122.919 0.487 . . . . 0.0 110.308 -170.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.9 p -150.37 64.37 0.95 Allowed 'General case' 0 C--N 1.353 0.759 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -177.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.557 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -35.98 77.86 0.0 OUTLIER Glycine 0 C--N 1.355 1.627 0 C-N-CA 125.13 1.347 . . . . 0.0 116.407 167.815 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -68.41 -28.75 67.36 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.127 0.971 . . . . 0.0 110.989 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? 74.52 111.37 0.07 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 124.924 1.29 . . . . 0.0 110.387 -174.819 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -116.6 155.82 28.06 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.17 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -29.97 66.29 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -135.4 150.96 50.02 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 122.82 0.448 . . . . 0.0 109.859 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -60.73 -30.4 69.96 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.977 0.911 . . . . 0.0 111.052 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -53.16 -45.8 68.63 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.828 0.705 . . . . 0.0 110.874 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.0 m -68.03 -30.46 69.7 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 t -74.56 -46.42 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.203 0.601 . . . . 0.0 110.024 -176.46 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -73.32 -37.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.664 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.65 -40.73 92.8 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 124.221 0.951 . . . . 0.0 109.354 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.99 -37.72 78.9 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.322 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -70.8 -41.19 71.94 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.804 0.841 . . . . 0.0 109.835 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.98 -28.72 68.49 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.273 0.629 . . . . 0.0 111.301 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -82.13 -53.53 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.539 1.136 . . . . 0.0 110.965 -174.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.03 -15.57 16.73 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.213 -166.524 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -137.11 52.73 5.94 Favored Pre-proline 0 CA--C 1.57 1.747 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -173.213 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -60.83 -22.35 73.5 Favored 'Trans proline' 0 C--N 1.391 2.777 0 C-N-CA 122.121 1.881 . . . . 0.0 112.379 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -115.85 96.47 5.61 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 171.232 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 69.7 t . . . . . 0 C--O 1.255 1.371 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.913 177.344 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.0 mtm 62.65 29.56 16.88 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 124.345 1.058 . . . . 0.0 110.913 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.508 HH11 ' HA ' ' A' ' 24' ' ' LYS . 34.4 ttp85 -169.36 71.22 0.07 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.588 1.555 . . . . 0.0 106.821 -174.127 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -141.13 97.38 3.16 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -169.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.466 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 81.7 m-85 -91.55 108.03 19.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.164 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.1 mm -109.15 149.74 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.576 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 25.4 t -94.01 -23.86 17.86 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 0.0 110.505 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 113.97 -27.18 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 128.533 2.733 . . . . 0.0 111.024 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -135.88 -51.66 0.73 Allowed 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.652 0.739 . . . . 0.0 109.927 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 p -113.34 57.27 0.68 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.833 -172.481 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.576 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -159.91 116.12 2.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.962 0.905 . . . . 0.0 109.578 165.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -68.34 -48.92 63.55 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.07 164.28 9.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.368 1.067 . . . . 0.0 109.627 160.62 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.466 ' HB2' ' HB2' ' A' ' 14' ' ' TYR . 88.5 m-85 -131.27 143.54 50.63 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.516 0.726 . . . . 0.0 109.815 167.731 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.508 ' HA ' HH11 ' A' ' 12' ' ' ARG . 25.9 ttpp -74.81 -24.83 58.69 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.071 0.948 . . . . 0.0 110.791 173.032 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -139.85 140.2 36.49 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.692 0.797 . . . . 0.0 110.336 -171.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.8 t -67.78 -25.88 65.83 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.234 172.687 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.4 m80 -70.44 -38.19 74.47 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.816 0.446 . . . . 0.0 110.799 174.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.66 -44.79 85.24 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 122.136 0.97 . . . . 0.0 109.617 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.64 -37.35 81.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.661 -1.609 . . . . 0.0 110.999 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.68 74.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.644 0.777 . . . . 0.0 112.23 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.677 HG12 ' HB ' ' A' ' 50' ' ' THR . 87.3 t -62.94 -44.74 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.649 0.78 . . . . 0.0 110.468 176.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -69.27 -38.02 78.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.84 0.856 . . . . 0.0 110.732 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.534 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 37.3 ttp180 -70.04 0.74 5.51 Favored 'General case' 0 C--O 1.21 -0.986 0 C-N-CA 124.319 1.047 . . . . 0.0 111.743 -172.471 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -46.43 -17.56 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 124.895 1.278 . . . . 0.0 114.319 172.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -54.17 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 124.427 1.091 . . . . 0.0 109.449 174.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -96.39 7.98 45.15 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.887 0.875 . . . . 0.0 111.658 -170.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.534 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 3.6 t -56.3 -64.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -156.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.6 35.69 75.02 Favored Glycine 0 N--CA 1.474 1.188 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.414 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 38.4 mt-10 -146.1 -38.01 0.24 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.567 1.547 . . . . 0.0 108.122 -169.46 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt 72.16 78.21 0.2 Allowed Pre-proline 0 C--N 1.358 0.95 0 C-N-CA 125.483 1.513 . . . . 0.0 109.9 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.43 170.01 19.09 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 122.82 2.347 . . . . 0.0 111.384 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.7 mt -111.48 140.62 45.92 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.674 0.79 . . . . 0.0 109.757 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 143.66 50.99 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -173.454 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.0 t -63.56 106.52 0.96 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.43 -29.18 33.98 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.909 1.283 . . . . 0.0 112.027 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.6 mm -74.29 -47.9 38.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 123.17 0.588 . . . . 0.0 109.985 -176.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.0 p -142.96 -89.36 0.13 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 120.586 0.231 . . . . 0.0 111.109 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.602 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -156.23 132.81 3.44 Favored Glycine 0 C--N 1.339 0.75 0 CA-C-O 116.838 -2.09 . . . . 0.0 109.709 -170.769 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.1 t80 168.1 112.91 0.01 OUTLIER 'General case' 0 C--N 1.353 0.752 0 N-CA-C 103.065 -2.939 . . . . 0.0 103.065 170.652 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.677 ' HB ' HG12 ' A' ' 31' ' ' VAL . 2.9 m -113.63 134.98 54.41 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -175.368 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.597 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 4.8 p -159.62 159.16 32.82 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 124.089 0.868 . . . . 0.0 110.891 176.582 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.46 -10.68 59.44 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.319 1.048 . . . . 0.0 111.252 176.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -103.01 109.31 20.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.392 1.077 . . . . 0.0 108.994 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -52.06 -42.47 63.17 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.467 0.707 . . . . 0.0 111.712 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.89 -41.73 64.63 Favored 'General case' 0 CA--C 1.556 1.186 0 O-C-N 124.698 1.249 . . . . 0.0 111.999 177.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.597 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 20.0 t -61.19 -52.63 64.01 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.643 0.777 . . . . 0.0 111.653 -173.502 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -74.25 -33.42 63.32 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.315 178.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -52.35 -42.29 63.77 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.826 0.851 . . . . 0.0 112.637 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -80.14 -38.49 31.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -177.929 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.8 t60 -48.26 -34.19 9.93 Favored 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 162.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.41 -35.14 70.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 172.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -61.03 -27.41 68.31 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 167.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.496 ' HE2' ' HB3' ' A' ' 70' ' ' TYR . 52.2 mtpt -68.98 -31.15 69.79 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.845 0.458 . . . . 0.0 110.243 173.735 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -70.58 -20.34 62.78 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.41 0.684 . . . . 0.0 111.261 173.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -69.68 -39.15 77.15 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.922 0.489 . . . . 0.0 110.547 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -42.43 63.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.12 0.568 . . . . 0.0 109.803 171.195 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.1 t70 85.72 -70.07 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 113.881 -1.509 . . . . 0.0 111.311 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 t -61.56 -34.13 75.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.567 1.147 . . . . 0.0 113.458 -167.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -138.45 7.34 2.58 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.375 0.67 . . . . 0.0 111.603 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.496 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 58.5 m-85 60.01 2.3 0.4 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 176.561 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -93.63 -110.91 0.11 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.449 ' O ' ' HA ' ' A' ' 80' ' ' LYS . 99.0 m-85 -144.22 137.55 27.42 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 61.0 p -140.73 132.56 27.5 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 123.301 0.64 . . . . 0.0 110.09 -169.082 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.0 t -76.35 126.5 31.11 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.046 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.45 -27.83 69.38 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.526 0.603 . . . . 0.0 111.462 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.651 HD11 HG22 ' A' ' 98' ' ' VAL . 2.8 mt -88.24 -44.08 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.968 -170.785 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -131.69 -2.73 3.74 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 119.231 0.923 . . . . 0.0 112.335 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.17 31.72 56.51 Favored Glycine 0 C--N 1.362 2.001 0 N-CA-C 115.004 0.762 . . . . 0.0 115.004 174.493 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -62.61 -23.4 67.03 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.598 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 72' ' ' PHE . 43.9 mmtm 77.8 118.62 0.06 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.826 1.25 . . . . 0.0 111.228 175.762 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -125.7 162.57 24.73 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.69 0.796 . . . . 0.0 111.832 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -72.3 -32.5 66.65 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.856 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -150.14 165.34 33.13 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-O 121.014 0.435 . . . . 0.0 111.395 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -56.13 -40.66 74.11 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.931 1.293 . . . . 0.0 111.528 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.87 -41.97 68.1 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.045 0.841 . . . . 0.0 111.503 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.0 m -66.13 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.647 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.9 t -76.3 -42.9 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 C-N-CA 123.728 0.811 . . . . 0.0 110.11 -174.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.7 -41.39 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.301 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.74 -36.58 80.83 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 113.966 -1.47 . . . . 0.0 109.742 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -68.25 -45.15 73.99 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.572 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 ttpt -70.16 -40.26 74.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.693 0.797 . . . . 0.0 109.715 -167.955 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.3 -30.38 66.6 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.061 177.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -102.76 -40.64 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.46 0.704 . . . . 0.0 111.742 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.2 t -85.95 -17.78 34.45 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.611 1.165 . . . . 0.0 111.158 -170.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -134.88 58.09 25.93 Favored Pre-proline 0 CA--C 1.567 1.629 0 C-N-CA 123.006 0.522 . . . . 0.0 111.043 -176.498 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -67.21 -39.99 12.15 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 122.221 1.948 . . . . 0.0 111.371 175.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -111.01 94.53 5.04 Favored 'General case' 0 C--N 1.353 0.756 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 173.542 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.651 HG22 HD11 ' A' ' 76' ' ' ILE . 3.0 p . . . . . 0 C--O 1.248 1.011 0 C-N-CA 124.224 1.01 . . . . 0.0 109.711 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 . . . . . 0 CA--C 1.553 1.072 0 CA-C-O 120.952 0.406 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.406 ' HG3' ' HD2' ' A' ' 12' ' ' ARG . 15.6 ptt? -157.22 -40.29 0.07 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.729 0.811 . . . . 0.0 111.056 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.406 ' HD2' ' HG3' ' A' ' 11' ' ' MET . 5.1 mpt_? -86.0 46.6 1.34 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.398 0.618 . . . . 0.0 109.633 172.463 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -128.14 94.23 3.86 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.196 0.998 . . . . 0.0 108.817 -167.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.3 118.77 20.11 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 126.111 1.764 . . . . 0.0 109.077 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.513 HG23 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -114.64 151.13 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -173.198 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.595 ' H ' ' HB2' ' A' ' 20' ' ' ALA . 2.2 t -81.61 -23.53 36.97 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.712 0.805 . . . . 0.0 111.281 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.513 ' H ' HG23 ' A' ' 15' ' ' ILE . 36.1 tt0 85.87 -5.46 0.82 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.491 1.516 . . . . 0.0 110.288 174.202 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -134.76 -51.01 0.78 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.447 0.699 . . . . 0.0 109.311 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -144.27 79.37 1.61 Allowed 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.003 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.595 ' HB2' ' H ' ' A' ' 16' ' ' CYS . . . -163.24 129.29 3.25 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.748 1.219 . . . . 0.0 109.293 164.72 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.524 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 35.3 ptt180 -66.61 -59.68 3.39 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.184 0.927 . . . . 0.0 108.731 175.694 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.524 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -176.22 146.45 0.66 Allowed 'General case' 0 C--N 1.354 0.777 0 C-N-CA 124.941 1.296 . . . . 0.0 108.519 169.61 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -119.34 139.13 52.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 173.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -89.42 0.38 56.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.313 0.245 . . . . 0.0 110.863 174.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 m -137.75 133.01 33.61 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.282 0.633 . . . . 0.0 110.052 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.8 p -61.79 -38.5 88.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.382 1.073 . . . . 0.0 111.526 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.476 ' O ' HG21 ' A' ' 31' ' ' VAL . 51.7 m-70 -62.48 -40.17 95.8 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.993 0.517 . . . . 0.0 111.47 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.79 -45.11 95.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.718 0.807 . . . . 0.0 110.175 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.42 -40.96 98.26 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.957 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.05 -30.32 71.27 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.227 0.611 . . . . 0.0 111.896 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.476 HG21 ' O ' ' A' ' 27' ' ' HIS . 81.2 t -65.98 -41.54 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.46 0.704 . . . . 0.0 110.465 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -68.44 -40.39 81.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.559 0.744 . . . . 0.0 110.83 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -65.09 -3.34 3.57 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.928 1.291 . . . . 0.0 112.128 -175.116 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -45.16 -24.41 0.25 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 125.193 1.397 . . . . 0.0 114.115 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.6 tp -87.2 -40.47 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 C-N-CA 124.323 1.049 . . . . 0.0 110.598 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -98.57 -19.04 17.82 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -172.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -62.03 -49.06 77.51 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -158.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.97 -31.1 3.75 Favored Glycine 0 C--N 1.338 0.665 0 CA-C-O 120.06 -0.3 . . . . 0.0 112.68 -164.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -111.17 78.85 1.15 Allowed 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 172.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -58.12 121.89 54.48 Favored Pre-proline 0 N--CA 1.478 0.957 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.099 -174.627 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -63.47 -86.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.741 2.294 . . . . 0.0 111.981 -172.468 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -145.55 100.65 3.47 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -142.18 126.95 18.11 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.371 0.668 . . . . 0.0 109.743 -176.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 t -64.67 109.4 2.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.872 1.269 . . . . 0.0 111.27 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -87.6 49.26 1.77 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.759 1.224 . . . . 0.0 110.085 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mm -133.9 -3.47 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.606 0 C-N-CA 125.528 1.531 . . . . 0.0 108.004 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.2 p 179.66 -133.44 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 102.745 -3.058 . . . . 0.0 102.745 -165.496 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.486 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.68 129.55 3.24 Favored Glycine 0 C--N 1.306 -1.117 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 161.118 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -176.79 113.29 0.1 Allowed 'General case' 0 C--N 1.354 0.803 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 -170.281 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 m -115.55 140.68 48.94 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 63.0 m -133.01 161.58 33.99 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.555 1.142 . . . . 0.0 110.875 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -97.24 -31.88 12.2 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.148 0.979 . . . . 0.0 109.462 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -97.28 130.71 44.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.152 0.981 . . . . 0.0 110.227 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -57.73 -44.03 85.7 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.57 1.148 . . . . 0.0 111.416 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.73 -40.56 69.39 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.591 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 t -56.92 -55.43 34.6 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.738 0.815 . . . . 0.0 112.302 -175.328 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.431 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 2.2 pt? -75.83 -27.94 58.07 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 119.332 -0.366 . . . . 0.0 111.673 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.451 ' O ' ' HG3' ' A' ' 61' ' ' MET . 6.3 t30 -58.92 -39.82 82.7 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.787 0.835 . . . . 0.0 112.744 175.268 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -79.69 -45.94 18.04 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 68.7 t60 -48.21 -37.73 16.61 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 168.03 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.451 ' HG3' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -72.09 -35.22 69.15 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 119.647 1.112 . . . . 0.0 110.759 178.105 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.45 -31.4 72.11 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.058 0.543 . . . . 0.0 111.277 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HB3' ' HZ3' ' A' ' 63' ' ' LYS . 3.8 mmmp? -58.54 -30.32 67.01 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.933 173.535 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 96.8 m-70 -77.27 -10.73 59.61 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.064 0.546 . . . . 0.0 111.798 175.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -91.58 -33.74 15.01 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.602 0.361 . . . . 0.0 110.811 -171.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.79 3.9 19.44 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.169 0.588 . . . . 0.0 110.484 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -44.24 81.37 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.916 2.086 . . . . 0.0 114.203 -171.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 26.1 m -79.37 -13.16 59.8 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.239 -1.346 . . . . 0.0 111.495 171.62 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -70.15 -35.06 73.77 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.682 0.393 . . . . 0.0 110.032 171.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 58.47 81.12 0.16 Allowed 'General case' 0 C--N 1.354 0.773 0 C-N-CA 124.783 1.233 . . . . 0.0 110.721 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -65.84 -43.13 89.42 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.617 1.167 . . . . 0.0 111.112 -175.47 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -94.33 140.09 30.24 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.094 0.958 . . . . 0.0 108.638 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 77.2 p -151.49 164.76 36.07 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 123.921 0.888 . . . . 0.0 110.496 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.649 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 5.1 t -100.32 124.18 45.47 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 170.256 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -70.56 -5.4 28.78 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.246 0.475 . . . . 0.0 111.739 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.5 -32.13 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.725 0.81 . . . . 0.0 109.15 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.4 p -170.32 70.59 0.06 Allowed 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . 0.649 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -39.46 76.5 0.0 OUTLIER Glycine 0 N--CA 1.48 1.567 0 N-CA-C 117.672 1.829 . . . . 0.0 117.672 175.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -66.68 -21.87 66.09 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.185 0.994 . . . . 0.0 111.264 171.226 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm 70.86 103.2 0.06 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.987 1.315 . . . . 0.0 109.628 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.407 ' HB3' ' HB3' ' A' ' 86' ' ' SER . 70.2 m-85 -107.41 160.53 15.57 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.297 0.639 . . . . 0.0 111.55 -167.395 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.51 -38.66 81.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.361 1.065 . . . . 0.0 112.629 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -166.66 172.73 10.32 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 123.831 0.707 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -55.6 -34.57 64.98 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.284 1.433 . . . . 0.0 112.578 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -54.86 -45.72 74.6 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 123.801 0.688 . . . . 0.0 111.182 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.407 ' HB3' ' HB3' ' A' ' 81' ' ' PHE . 26.3 t -69.81 -30.83 68.45 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.728 0.642 . . . . 0.0 111.107 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.7 t -73.31 -44.61 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 0.0 109.98 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.43 -38.07 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 113.731 -1.577 . . . . 0.0 109.169 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.19 -38.48 82.06 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.772 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -66.67 -49.69 65.34 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.448 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.592 ' HZ2' ' HB3' ' A' ' 91' ' ' LYS . 5.7 ttpm? -70.82 -39.3 73.11 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.031 0.532 . . . . 0.0 110.113 -168.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.96 -23.91 67.36 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.081 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -99.23 -44.49 6.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 123.332 0.395 . . . . 0.0 111.425 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.9 t -82.14 -26.73 33.25 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.457 1.103 . . . . 0.0 111.204 -173.219 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -135.37 61.7 45.96 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 122.707 0.403 . . . . 0.0 111.49 -175.199 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.37 -24.54 12.16 Favored 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 121.272 1.315 . . . . 0.0 110.274 162.806 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -124.48 98.46 5.75 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.401 1.48 . . . . 0.0 107.371 171.38 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.7 p . . . . . 0 CA--C 1.549 0.917 0 C-N-CA 124.41 1.084 . . . . 0.0 109.387 175.038 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.4 m80 . . . . . 0 N--CA 1.483 1.212 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.6 ttt -158.25 138.75 12.71 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 123.743 0.817 . . . . 0.0 109.678 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -153.96 27.42 0.48 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.995 0.918 . . . . 0.0 109.194 174.448 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.447 ' HB2' ' HB2' ' A' ' 22' ' ' ALA . 6.6 p-10 -149.68 98.86 2.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.035 -170.321 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -76.97 119.74 21.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.618 -1.628 . . . . 0.0 109.663 174.83 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -105.03 149.18 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.687 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 1.4 t -83.6 163.39 20.39 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.611 0.72 . . . . 0.0 110.283 176.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 31.5 tt0 -58.4 -32.76 68.93 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.523 -1.671 . . . . 0.0 111.217 -176.898 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -138.4 -49.52 0.55 Allowed 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.097 0.559 . . . . 0.0 109.978 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.2 p -124.84 72.18 1.21 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.605 -169.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.687 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -141.65 135.09 29.59 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.983 150.495 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -69.19 -58.94 3.39 Favored 'General case' 0 CA--C 1.555 1.145 0 O-C-N 124.241 0.963 . . . . 0.0 109.483 168.575 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.447 ' HB2' ' HB2' ' A' ' 13' ' ' ASP . . . -172.99 133.4 0.54 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 123.567 0.747 . . . . 0.0 111.083 170.483 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -114.35 130.75 56.69 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -80.29 3.73 20.02 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 118.44 0.564 . . . . 0.0 111.738 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' SER . . . . . 0.439 ' HB3' ' ND2' ' A' ' 28' ' ' ASN . 16.7 t -137.4 134.88 36.42 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.138 0.975 . . . . 0.0 109.827 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.4 p -69.14 -28.83 66.8 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.832 0.853 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.465 ' O ' HG21 ' A' ' 31' ' ' VAL . 67.9 t60 -62.97 -44.29 96.46 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.176 0.59 . . . . 0.0 110.252 176.213 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.444 ' ND2' HH12 ' A' ' 52' ' ' ARG . 3.3 m-80 -53.7 -51.28 63.78 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.119 0.968 . . . . 0.0 111.464 177.529 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.8 tp -67.7 -34.86 77.72 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.287 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.43 88.26 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.056 0.543 . . . . 0.0 111.004 176.51 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.665 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 61.8 t -65.17 -36.67 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.553 175.681 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -65.28 -40.98 94.58 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.026 0.93 . . . . 0.0 110.75 174.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.449 ' HG2' ' HB2' ' A' ' 36' ' ' HIS . 17.2 ttt180 -75.08 9.74 1.83 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 123.907 0.883 . . . . 0.0 111.505 -174.441 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.532 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 25.7 ptt? -49.68 -27.47 4.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.307 1.443 . . . . 0.0 113.705 169.037 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.8 tp -86.82 -29.15 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.225 -176.643 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.449 ' HB2' ' HG2' ' A' ' 33' ' ' ARG . 58.0 m-70 -99.9 -60.24 1.57 Allowed 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -167.7 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -104.35 24.99 10.7 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -149.736 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.95 43.26 34.68 Favored Glycine 0 N--CA 1.478 1.497 0 C-N-CA 119.872 -1.156 . . . . 0.0 113.496 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.532 ' O ' ' HA ' ' A' ' 34' ' ' MET . 11.1 mm-40 -146.75 114.99 6.64 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 124.592 1.157 . . . . 0.0 108.229 -166.264 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -112.4 94.0 25.2 Favored Pre-proline 0 N--CA 1.472 0.665 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 167.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.665 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 28.3 Cg_endo -58.32 -67.21 0.06 OUTLIER 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 123.543 2.829 . . . . 0.0 112.188 -174.092 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.505 HD23 ' HB2' ' A' ' 54' ' ' LYS . 86.3 mt -146.23 90.88 2.0 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -136.48 135.6 38.72 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.794 0.437 . . . . 0.0 111.904 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.498 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 7.5 t -71.58 105.35 3.61 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.698 1.199 . . . . 0.0 109.725 171.435 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -93.27 49.49 1.41 Allowed 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.574 1.178 . . . . 0.0 110.185 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 3.1 mp -114.57 -55.31 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 169.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 21.3 p -112.7 -113.03 0.33 Allowed 'General case' 0 C--O 1.238 0.462 0 N-CA-C 103.997 -2.594 . . . . 0.0 103.997 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -148.32 154.63 25.98 Favored Glycine 0 C--N 1.313 -0.742 0 N-CA-C 108.626 -1.79 . . . . 0.0 108.626 152.972 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.498 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.9 t80 172.48 114.37 0.01 OUTLIER 'General case' 0 C--N 1.351 0.662 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -173.802 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.1 m -129.4 138.31 51.42 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 52' ' ' ARG . 52.0 t -136.36 167.13 21.91 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.131 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.444 HH12 ' ND2' ' A' ' 28' ' ' ASN . 16.8 tpp85 -70.44 -33.82 71.75 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.239 176.384 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -121.43 134.04 55.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.376 0.67 . . . . 0.0 109.918 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.505 ' HB2' HD23 ' A' ' 42' ' ' LEU . 5.5 ttpm? -59.29 -21.76 60.16 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.495 0.718 . . . . 0.0 111.374 174.979 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.98 -28.13 15.74 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.647 1.179 . . . . 0.0 112.582 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -77.52 -55.0 5.74 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.27 0.628 . . . . 0.0 112.358 175.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.559 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -75.86 -34.55 60.04 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -171.85 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . 0.45 ' HA ' ' HE2' ' A' ' 61' ' ' MET . 1.3 p-10 -55.51 -37.48 67.95 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.496 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 45.8 p-90 -86.04 -35.85 20.07 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 118.251 0.478 . . . . 0.0 111.02 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.559 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 65.8 t60 -48.26 -32.23 6.98 Favored 'General case' 0 CA--C 1.572 1.822 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 171.152 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.45 ' HE2' ' HA ' ' A' ' 58' ' ' ASN . 23.8 ptp -69.48 -32.19 70.94 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.935 -1.103 . . . . 0.0 112.35 170.612 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 39.3 ttmt -58.11 -29.17 65.28 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 122.921 0.488 . . . . 0.0 111.457 169.507 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.417 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 31.2 mmmt -63.61 -38.09 89.8 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.916 0.486 . . . . 0.0 110.61 175.53 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.438 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.3 m-70 -71.61 -24.31 61.86 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.116 0.567 . . . . 0.0 110.281 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -84.15 -23.86 30.45 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.016 0.926 . . . . 0.0 109.057 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.18 -4.65 18.59 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.239 1.016 . . . . 0.0 111.529 -169.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -105.98 -18.02 14.17 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 175.421 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.2 m -90.99 -69.01 0.76 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.686 0.395 . . . . 0.0 110.906 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -136.99 -44.26 0.57 Allowed 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -174.064 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -89.47 65.52 7.09 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -176.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -54.05 -55.6 25.95 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.302 1.441 . . . . 0.0 111.908 -169.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.423 ' O ' ' HA ' ' A' ' 80' ' ' LYS . 80.6 m-85 -139.98 137.83 35.02 Favored 'General case' 0 CA--C 1.523 -0.072 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.0 m -120.28 138.67 53.55 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 124.952 1.301 . . . . 0.0 109.339 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 9.8 t -87.19 105.63 17.33 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -58.74 -8.79 1.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.5 HD12 HG13 ' A' ' 98' ' ' VAL . 8.4 mt -93.9 -48.05 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 123.553 0.741 . . . . 0.0 112.156 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.437 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 15.9 p -132.06 5.39 4.17 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.35 34.83 59.79 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 123.563 0.601 . . . . 0.0 114.366 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.437 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 8.1 tmtm? -65.21 -28.86 69.66 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.063 0.545 . . . . 0.0 111.712 -174.181 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.423 ' HA ' ' O ' ' A' ' 72' ' ' PHE . 75.4 mmtt 71.08 116.62 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.658 1.183 . . . . 0.0 110.872 172.952 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.403 ' CZ ' ' HD2' ' A' ' 79' ' ' LYS . 89.5 m-85 -127.46 160.34 31.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.623 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.47 -40.14 95.14 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.91 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -136.59 154.59 50.64 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 123.277 0.631 . . . . 0.0 109.981 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -59.93 -31.19 69.62 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.347 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.55 -45.16 81.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.62 0.768 . . . . 0.0 110.714 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.5 m -67.87 -30.82 70.29 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 123.77 0.669 . . . . 0.0 111.776 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.29 -48.53 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 C-N-CA 123.431 0.692 . . . . 0.0 110.425 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.0 t -73.68 -35.07 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 109.657 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.36 95.42 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.282 173.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -72.81 -34.74 67.07 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.689 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -73.78 -36.81 65.1 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.316 0.647 . . . . 0.0 109.823 -176.368 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.38 -38.54 89.98 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.033 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -97.01 -46.85 6.03 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -169.462 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.3 t -80.28 -20.74 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.633 0.773 . . . . 0.0 110.673 -173.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -138.28 68.35 47.28 Favored Pre-proline 0 CA--C 1.561 1.399 0 C-N-CA 123.147 0.579 . . . . 0.0 109.532 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -44.21 -35.5 8.04 Favored 'Trans proline' 0 C--N 1.39 2.75 0 C-N-CA 123.685 2.924 . . . . 0.0 113.831 170.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -108.63 97.91 7.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 172.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.5 HG13 HD12 ' A' ' 76' ' ' ILE . 65.4 t . . . . . 0 C--O 1.255 1.344 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.417 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 120.974 0.416 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.455 ' HG3' ' HG2' ' A' ' 12' ' ' ARG . 20.0 ptp -168.37 -47.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.1 0.96 . . . . 0.0 109.638 173.68 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.455 ' HG2' ' HG3' ' A' ' 11' ' ' MET . 21.2 ptt180 -152.79 29.45 0.52 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.157 0.983 . . . . 0.0 108.716 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -143.54 94.82 2.65 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.746 1.26 . . . . 0.0 108.786 -166.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -99.84 133.52 44.08 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 113.516 -1.675 . . . . 0.0 109.57 -174.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.593 HG23 ' H ' ' A' ' 17' ' ' GLU . 6.7 mm -115.18 149.49 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.603 0.761 . . . . 0.0 109.582 -166.818 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.572 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.8 t -85.49 -20.39 29.79 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.531 0.732 . . . . 0.0 109.979 174.064 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.593 ' H ' HG23 ' A' ' 15' ' ' ILE . 36.7 tt0 85.95 -3.97 0.79 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 126.235 1.814 . . . . 0.0 111.19 171.095 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -135.87 -49.2 0.69 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -136.21 77.14 1.64 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.357 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.572 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -170.85 128.04 0.75 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.605 1.162 . . . . 0.0 109.394 163.354 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.455 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 34.1 ptt180 -68.86 -58.25 4.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.159 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.455 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -173.2 152.85 2.34 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 124.135 0.974 . . . . 0.0 109.616 164.48 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -125.94 152.05 46.15 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.558 1.143 . . . . 0.0 108.29 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -59.03 -30.31 67.93 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 m -143.21 156.11 44.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.269 0.628 . . . . 0.0 110.98 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.546 ' HA ' HD23 ' A' ' 29' ' ' LEU . 41.9 m -57.11 -36.52 70.73 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.608 171.726 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -74.13 -35.41 64.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.087 0.555 . . . . 0.0 110.732 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.78 -47.21 86.59 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.405 0.682 . . . . 0.0 110.467 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.546 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.2 OUTLIER -66.98 -28.99 68.71 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.828 0.851 . . . . 0.0 110.747 174.232 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.71 -27.52 69.27 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.936 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.11 -41.45 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 122.749 0.42 . . . . 0.0 110.212 173.688 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -64.92 -38.45 91.01 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.703 0.801 . . . . 0.0 110.222 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.461 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 24.9 ttt85 -70.03 5.95 1.42 Allowed 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 124.859 1.263 . . . . 0.0 111.723 -176.115 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.0 ptm -46.11 -18.4 0.05 Allowed 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 125.314 1.446 . . . . 0.0 113.574 171.192 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.98 -52.88 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.919 0 C-N-CA 125.403 1.481 . . . . 0.0 110.428 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.461 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -100.42 6.45 44.42 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.535 0.734 . . . . 0.0 112.65 -172.861 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.4 t -58.88 -55.4 35.58 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -163.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.08 -31.41 3.13 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-O 120.083 -0.287 . . . . 0.0 112.62 -171.811 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -86.75 -48.54 8.16 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.883 0.873 . . . . 0.0 110.886 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 60.5 mttp 70.3 122.75 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 126.107 1.763 . . . . 0.0 111.429 -168.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.27 -170.84 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.217 0 C-N-CA 121.979 1.786 . . . . 0.0 110.679 164.388 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.438 HD12 ' HB3' ' A' ' 54' ' ' LYS . 95.4 mt -92.38 98.22 11.35 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -122.46 130.15 52.77 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.389 1.076 . . . . 0.0 110.134 -167.013 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.448 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 21.1 t -69.0 107.05 2.98 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.33 170.103 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.49 27.28 0.44 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.581 1.152 . . . . 0.0 111.693 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.448 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 21.8 mm -118.82 -3.31 9.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.479 1.112 . . . . 0.0 108.773 -168.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.4 p 179.93 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.523 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 -169.029 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.26 135.47 5.24 Favored Glycine 0 C--N 1.309 -0.918 0 N-CA-C 107.142 -2.383 . . . . 0.0 107.142 158.356 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -179.36 111.86 0.05 Allowed 'General case' 0 C--N 1.346 0.431 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.2 m -128.71 146.52 50.86 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -166.859 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 t -157.48 179.04 9.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.595 -177.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -110.52 -3.43 16.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.409 0.684 . . . . 0.0 110.149 169.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -106.02 104.64 14.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 172.44 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.438 ' HB3' HD12 ' A' ' 42' ' ' LEU . 51.5 pttt -57.64 -33.54 68.39 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.622 0.769 . . . . 0.0 112.801 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.41 -41.73 69.63 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.758 0.823 . . . . 0.0 112.097 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.3 m -52.08 -52.87 48.46 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.088 0.955 . . . . 0.0 112.616 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -77.85 -31.49 51.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.607 0.763 . . . . 0.0 111.995 177.77 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.69 -44.0 97.06 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.575 0.75 . . . . 0.0 112.968 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -81.03 -36.84 30.04 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -51.57 -30.72 21.88 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.456 1.102 . . . . 0.0 113.683 165.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.436 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 28.5 ttt -71.6 -39.57 70.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.102 0.561 . . . . 0.0 111.357 173.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -58.77 -34.43 71.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.273 0.629 . . . . 0.0 110.654 168.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -64.19 -29.42 70.53 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.628 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.436 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 82.7 m-70 -70.75 -11.6 61.05 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.882 -0.511 . . . . 0.0 111.794 172.815 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -102.42 -17.85 15.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.013 0.925 . . . . 0.0 108.586 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.65 -44.51 6.75 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.954 0.902 . . . . 0.0 110.645 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.643 ' HA ' ' HG2' ' A' ' 71' ' ' GLN . 8.1 m-20 -74.05 1.56 10.76 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 21.9 t -79.9 -64.24 1.23 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.513 0.725 . . . . 0.0 109.867 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -136.78 -29.31 0.94 Allowed 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.696 0.799 . . . . 0.0 111.868 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -115.79 68.64 0.72 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.116 0.566 . . . . 0.0 109.829 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.643 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 44.1 mt-30 -76.6 -10.35 59.32 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.185 -172.014 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -118.11 156.59 28.4 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 58.1 p -157.58 123.82 4.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 124.467 1.107 . . . . 0.0 108.562 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.9 t -70.69 114.03 8.37 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 169.008 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -60.12 -13.89 14.24 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -172.918 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mt -104.38 -31.41 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -175.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.542 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 19.4 p -136.2 -4.95 2.11 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.765 -1.209 . . . . 0.0 113.389 -178.001 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.05 33.75 85.26 Favored Glycine 0 C--N 1.347 1.185 0 C-N-CA 123.039 0.352 . . . . 0.0 113.381 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.542 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.0 tmtt? -65.76 -35.13 79.85 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.03 0.932 . . . . 0.0 112.103 -176.343 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? 73.67 120.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.816 1.246 . . . . 0.0 110.4 -176.625 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -128.56 162.42 27.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.913 0.885 . . . . 0.0 109.861 175.203 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.472 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 8.1 mm-40 -70.69 -28.3 64.66 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.437 0.695 . . . . 0.0 112.673 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.472 ' HD3' ' HB2' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -144.39 151.22 38.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.122 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -66.2 -25.1 66.77 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.632 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.65 -28.29 65.76 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.412 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 49.4 m -67.48 -31.7 72.03 Favored 'General case' 0 C--N 1.359 1.012 0 O-C-N 122.952 0.157 . . . . 0.0 110.923 171.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.4 t -75.15 -47.69 34.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.002 0.921 . . . . 0.0 110.196 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 70.6 t -73.34 -35.94 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.081 1.352 . . . . 0.0 109.959 -174.36 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.89 95.33 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.951 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . 0.412 ' HB3' ' O ' ' A' ' 86' ' ' SER . 2.3 t60 -71.41 -30.18 65.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.873 178.819 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.6 -41.0 69.47 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.412 1.085 . . . . 0.0 109.603 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.36 64.36 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.125 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.527 ' HB3' ' HZ2' ' A' ' 93' ' ' LYS . 8.1 mtpm? -105.58 -42.03 5.31 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.219 0.608 . . . . 0.0 112.34 -176.05 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.8 t -93.26 -23.08 18.64 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.096 0.958 . . . . 0.0 111.306 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.422 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 53.7 m-70 -131.86 43.49 1.11 Allowed Pre-proline 0 CA--C 1.57 1.732 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.057 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.422 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 37.7 Cg_exo -60.95 -34.48 90.86 Favored 'Trans proline' 0 C--N 1.395 2.975 0 CA-C-N 122.083 1.78 . . . . 0.0 112.087 171.854 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -113.83 97.6 6.5 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 124.606 1.162 . . . . 0.0 108.691 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 C--O 1.256 1.413 0 C-N-CA 124.313 1.045 . . . . 0.0 109.207 173.654 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 46.1 ttm -155.35 -66.55 0.12 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.841 0.456 . . . . 0.0 110.527 -177.628 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.4 ttt-85 -107.21 32.24 4.78 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 122.563 1.173 . . . . 0.0 108.542 -178.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -164.71 114.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -168.374 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -121.54 120.62 35.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.792 0.837 . . . . 0.0 110.715 -178.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 43.0 mm -100.95 110.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.097 -177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.7 t -61.97 90.82 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 158.473 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 18.47 -59.44 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 129.101 2.96 . . . . 0.0 116.563 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -121.35 -39.28 2.69 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.474 -165.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.25 -23.36 19.35 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.77 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.32 125.88 35.3 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -170.829 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -69.62 -52.01 29.77 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.029 163.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -177.43 138.17 0.22 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 125.24 1.416 . . . . 0.0 108.568 160.555 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -105.02 151.81 23.5 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -63.29 -34.71 78.27 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.309 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 m -146.95 154.44 41.27 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 121.124 0.488 . . . . 0.0 111.817 -169.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 p -61.03 -45.31 95.3 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.72 1.208 . . . . 0.0 112.142 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -68.78 -35.63 77.29 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.26 -51.69 67.2 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.505 0.722 . . . . 0.0 111.106 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -37.11 85.12 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.984 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.06 -29.23 68.41 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 124.137 0.898 . . . . 0.0 112.532 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.99 -45.21 95.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.219 0.608 . . . . 0.0 110.972 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -35.83 70.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.333 0.653 . . . . 0.0 109.479 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.65 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 39.1 ttt85 -61.96 -8.08 4.68 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.348 1.459 . . . . 0.0 112.361 -175.827 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.0 ptm -46.04 -12.55 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 -178.159 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -53.42 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 C-N-CA 124.587 1.155 . . . . 0.0 108.641 172.846 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.547 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -101.82 14.37 32.14 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.399 1.479 . . . . 0.0 112.435 -176.161 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.65 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 13.5 t -57.89 -70.47 0.13 Allowed 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -154.284 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.03 32.86 81.8 Favored Glycine 0 N--CA 1.479 1.541 0 CA-C-N 118.994 0.815 . . . . 0.0 111.099 -169.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.441 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 10.6 mm-40 -147.5 -42.31 0.17 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.517 1.927 . . . . 0.0 106.913 -172.777 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? 61.5 96.67 0.04 OUTLIER Pre-proline 0 C--N 1.356 0.878 0 C-N-CA 126.067 1.747 . . . . 0.0 112.245 174.019 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.07 -173.23 1.6 Allowed 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.4 2.067 . . . . 0.0 110.185 161.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -120.3 118.47 30.49 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.802 0.441 . . . . 0.0 110.064 -175.519 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -116.06 148.78 39.85 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.577 0.751 . . . . 0.0 109.664 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.461 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.8 t -66.37 107.74 2.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.475 0.71 . . . . 0.0 109.962 167.285 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -75.91 8.71 2.89 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.646 0.779 . . . . 0.0 112.893 -178.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.461 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 39.2 mm -88.77 -56.24 5.44 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.653 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.504 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.3 p -119.44 -107.76 0.37 Allowed 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 104.139 -2.541 . . . . 0.0 104.139 175.155 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.504 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.16 164.18 29.24 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 160.097 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.0 t80 167.47 112.61 0.01 OUTLIER 'General case' 0 C--N 1.353 0.725 0 N-CA-C 103.379 -2.822 . . . . 0.0 103.379 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m -117.1 135.31 53.84 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.577 0.703 . . . . 0.0 109.765 -165.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.4 t -151.89 164.4 37.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.837 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -81.57 -31.14 32.74 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.069 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -103.99 127.18 51.54 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.372 1.069 . . . . 0.0 109.487 -173.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -55.86 -30.21 61.14 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.723 0.639 . . . . 0.0 112.029 175.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.52 83.44 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.397 1.079 . . . . 0.0 112.901 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -59.97 -54.36 46.94 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.343 0.657 . . . . 0.0 111.674 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.486 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.5 OUTLIER -75.43 -24.11 57.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 123.744 0.818 . . . . 0.0 112.013 177.605 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -52.0 -42.98 63.43 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.553 0.741 . . . . 0.0 112.751 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -79.67 -48.37 13.81 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 83.2 t60 -48.52 -39.98 25.2 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.157 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.417 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 0.0 OUTLIER -71.01 -37.53 72.63 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 119.991 1.268 . . . . 0.0 110.551 175.861 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -65.24 -26.35 68.07 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.532 0.733 . . . . 0.0 111.496 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -35.54 79.44 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.417 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 94.6 m-70 -68.37 -16.98 64.12 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.136 0.574 . . . . 0.0 111.659 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -81.19 -25.17 36.97 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.278 0.631 . . . . 0.0 109.648 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.37 -33.46 7.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.738 0.815 . . . . 0.0 111.716 -170.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -67.45 -22.11 65.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -158.092 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 m -66.96 -53.5 31.01 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.825 0.85 . . . . 0.0 111.765 -173.607 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -135.95 -44.39 0.65 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.084 0.553 . . . . 0.0 110.377 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -98.59 58.33 1.21 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.658 0.783 . . . . 0.0 109.503 -172.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -61.43 -14.34 27.55 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.153 0.981 . . . . 0.0 111.759 -168.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -134.85 141.06 46.28 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 125.045 1.338 . . . . 0.0 107.922 175.037 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.528 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 68.8 p -128.65 168.97 15.02 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 124.9 1.28 . . . . 0.0 109.892 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 37.2 t -123.6 97.31 5.32 Favored 'General case' 0 C--O 1.2 -1.534 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -56.72 -14.83 3.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -169.245 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 mt -87.35 -22.87 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.749 0.419 . . . . 0.0 111.474 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.654 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.4 p -147.56 4.14 0.77 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 53.09 37.02 53.45 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.161 0.886 . . . . 0.0 114.72 -177.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.654 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.1 tmtt? -66.3 -37.91 86.5 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 111.646 -172.228 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.528 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 71.5 mmtt 72.25 117.02 0.05 OUTLIER 'General case' 0 C--N 1.362 1.15 0 C-N-CA 124.797 1.239 . . . . 0.0 110.11 176.751 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.402 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.6 m-85 -125.31 164.99 19.17 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.57 -39.51 94.57 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 114.408 -1.269 . . . . 0.0 111.54 176.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -145.8 155.83 43.18 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.021 0.528 . . . . 0.0 110.023 -177.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.9 pptp? -64.34 -24.42 67.64 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.102 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.52 -47.1 80.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.062 0.545 . . . . 0.0 110.484 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -65.81 -30.77 71.45 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.423 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 86.5 t -72.92 -49.26 40.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.714 0.805 . . . . 0.0 110.194 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.78 -35.37 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.963 1.305 . . . . 0.0 109.182 -174.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.52 -44.41 94.32 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.517 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.05 -35.0 66.62 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.42 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -69.83 -38.81 76.65 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.277 1.031 . . . . 0.0 109.244 -172.021 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.24 -23.07 66.35 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.459 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -91.94 -50.82 5.51 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 121.197 0.522 . . . . 0.0 110.423 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.7 t -85.12 -23.92 28.24 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.825 1.25 . . . . 0.0 111.795 -169.14 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.7 m-70 -132.34 59.52 44.41 Favored Pre-proline 0 CA--C 1.562 1.439 0 C-N-CA 122.557 0.343 . . . . 0.0 111.715 -172.779 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.1 -31.71 11.79 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 121.855 1.704 . . . . 0.0 111.045 170.167 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -128.95 98.14 4.85 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.965 1.306 . . . . 0.0 107.836 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 89.2 t . . . . . 0 C--O 1.249 1.05 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.298 178.514 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.2 t-160 . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -91.93 23.88 3.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.716 0.807 . . . . 0.0 112.48 -170.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -143.85 131.99 21.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.135 0.974 . . . . 0.0 108.377 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 59.85 95.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.117 1.367 . . . . 0.0 111.707 -177.646 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.27 113.11 24.69 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -177.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.4 mm -105.54 157.05 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.22 0.608 . . . . 0.0 109.576 -167.334 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.571 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 23.4 t -90.85 12.21 20.12 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.679 0.391 . . . . 0.0 111.205 173.396 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 87.54 -38.88 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.761 1.624 . . . . 0.0 110.08 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -137.41 -55.26 0.69 Allowed 'General case' 0 C--N 1.351 0.664 0 C-N-CA 122.73 0.412 . . . . 0.0 110.028 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 p -94.82 58.86 2.31 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.571 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -166.14 142.24 4.94 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.003 0.921 . . . . 0.0 110.46 160.724 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.411 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 10.2 ptp180 -68.0 -58.55 4.34 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 118.982 -0.532 . . . . 0.0 109.621 167.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.411 ' N ' ' HG3' ' A' ' 21' ' ' ARG . . . 174.28 134.87 0.04 OUTLIER 'General case' 0 C--N 1.358 0.961 0 C-N-CA 125.738 1.615 . . . . 0.0 108.0 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -108.46 164.52 12.27 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -56.4 -44.53 80.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.934 1.294 . . . . 0.0 111.339 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.0 m -146.21 168.59 20.65 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.301 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.512 ' HA ' HD23 ' A' ' 29' ' ' LEU . 51.0 p -64.62 -39.24 93.37 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.275 1.03 . . . . 0.0 112.617 -176.967 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -75.13 -37.0 61.57 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.395 0.678 . . . . 0.0 110.909 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.49 -41.93 73.71 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.911 0.885 . . . . 0.0 110.581 167.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.512 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -72.8 -33.81 66.48 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.899 178.236 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.607 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -62.75 -28.23 69.83 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.336 1.055 . . . . 0.0 111.9 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.2 t -50.29 -46.65 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 123.834 0.709 . . . . 0.0 111.49 168.593 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -77.06 -45.66 26.34 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.349 171.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.607 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 56.8 ttt180 -79.04 40.21 0.4 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.289 1.435 . . . . 0.0 110.155 -170.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -60.7 -52.77 63.69 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 123.824 0.85 . . . . 0.0 112.405 -162.155 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.2 tp -85.16 -17.89 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 49.3 m-70 -84.33 -42.3 15.91 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 120.613 1.552 . . . . 0.0 109.734 -156.7 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.3 t -70.9 -27.36 63.74 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 114.768 -1.106 . . . . 0.0 113.405 -165.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.58 33.88 12.69 Favored Glycine 0 C--N 1.342 0.874 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.183 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -110.83 -30.56 7.5 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.285 1.034 . . . . 0.0 109.98 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.9 pttt 44.55 72.84 1.09 Allowed Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 126.323 1.849 . . . . 0.0 112.572 -171.268 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.72 147.41 94.75 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.508 2.139 . . . . 0.0 111.581 175.41 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.473 ' O ' ' HA ' ' A' ' 50' ' ' THR . 91.2 mt -80.64 137.12 36.32 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -171.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.459 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 61.7 tt0 -117.65 139.3 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -168.254 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.71 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 1.8 t -64.28 112.79 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.936 0.894 . . . . 0.0 110.79 173.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -82.02 26.63 0.51 Allowed 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.689 0.796 . . . . 0.0 112.773 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.404 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 25.7 mm -105.64 -53.17 7.02 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 169.34 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.542 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 27.3 p -118.5 -109.33 0.36 Allowed 'General case' 0 C--N 1.346 0.443 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 173.864 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.542 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.02 165.92 29.35 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 108.624 -1.79 . . . . 0.0 108.624 155.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.693 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 23.8 t80 175.61 111.7 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.473 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -105.64 125.58 51.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -171.996 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.5 t -143.13 165.8 26.42 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.343 0.657 . . . . 0.0 111.622 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -70.18 -42.72 72.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.903 1.281 . . . . 0.0 110.835 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -110.98 131.37 55.1 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.548 0.739 . . . . 0.0 110.525 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -50.86 -37.26 42.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.793 1.237 . . . . 0.0 111.447 172.721 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -36.95 52.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.254 1.022 . . . . 0.0 112.515 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.8 m -69.47 -55.97 8.74 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.451 0.301 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -41.82 45.03 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -173.126 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -50.25 -54.18 22.99 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.769 0.827 . . . . 0.0 111.77 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.53 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 58.6 m95 -78.27 -33.92 49.28 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.331 -172.848 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -45.1 -41.17 7.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 124.049 0.843 . . . . 0.0 112.617 163.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.71 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 33.6 mtm -61.85 -48.01 82.49 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 117.465 0.121 . . . . 0.0 110.892 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.79 -39.54 77.77 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.102 0.876 . . . . 0.0 111.014 176.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.53 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 31.4 mmmt -59.42 -45.73 90.71 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 124.208 0.943 . . . . 0.0 110.221 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.06 9.61 28.36 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -172.226 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.8 -33.49 64.45 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.3 0.64 . . . . 0.0 111.118 171.83 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.65 -32.09 11.25 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 73.25 18.29 3.8 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 125.579 1.552 . . . . 0.0 110.303 -174.704 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.7 t -59.95 -26.88 66.34 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.573 0.749 . . . . 0.0 111.717 -170.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.485 ' HB3' ' HG2' ' A' ' 71' ' ' GLN . 97.4 m-85 -69.55 -46.63 65.97 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.441 0.696 . . . . 0.0 111.819 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 45.04 35.77 1.73 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 123.998 0.919 . . . . 0.0 112.383 -172.295 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.485 ' HG2' ' HB3' ' A' ' 69' ' ' PHE . 25.7 mm-40 -84.74 -5.51 59.32 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -167.489 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -140.31 132.57 28.22 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.635 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 32.6 p -156.94 165.89 34.9 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 125.154 1.382 . . . . 0.0 109.215 175.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.0 t -86.91 124.29 32.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -62.68 -25.86 68.36 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.987 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -92.44 -42.99 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.013 0.525 . . . . 0.0 112.221 -172.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.14 8.4 2.94 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 119.628 1.104 . . . . 0.0 113.142 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.4 37.43 18.71 Favored Glycine 0 N--CA 1.483 1.797 0 N-CA-C 117.769 1.868 . . . . 0.0 117.769 165.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -68.54 -26.98 65.7 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.855 0.827 . . . . 0.0 113.047 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.635 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.0 OUTLIER 77.61 121.36 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.667 1.587 . . . . 0.0 110.263 -172.335 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -119.32 170.19 9.33 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.945 0.898 . . . . 0.0 110.554 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.693 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 1.7 mm-40 -68.93 -28.64 66.83 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.799 -175.141 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -162.58 165.77 25.54 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.935 0.894 . . . . 0.0 109.31 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -60.65 -37.39 81.38 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.106 0.962 . . . . 0.0 111.009 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.85 -37.85 88.91 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.195 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.5 m -66.01 -29.97 70.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.966 0.506 . . . . 0.0 111.146 177.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 75.8 t -73.68 -48.58 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.268 1.027 . . . . 0.0 110.237 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.0 t -73.61 -34.48 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.874 -175.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.2 86.35 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.27 174.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -72.46 -32.65 66.43 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.346 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -70.23 -36.68 74.68 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.255 1.022 . . . . 0.0 109.362 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . 0.41 ' HB2' ' HD2' ' A' ' 21' ' ' ARG . . . -62.87 -36.36 83.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.749 175.075 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -87.97 -47.76 8.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.386 -171.362 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.6 t -104.13 -6.23 21.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.994 0.917 . . . . 0.0 111.763 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -135.29 50.75 4.89 Favored Pre-proline 0 CA--C 1.57 1.736 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.687 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.47 -51.69 10.63 Favored 'Trans proline' 0 C--N 1.397 3.129 0 C-N-CA 122.606 2.204 . . . . 0.0 112.395 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -141.88 96.23 2.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 171.744 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.251 1.159 0 C-N-CA 123.468 0.707 . . . . 0.0 110.032 176.865 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.5 m80 . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.8 ptm -134.42 -3.6 2.68 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.834 0.854 . . . . 0.0 110.721 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.76 63.31 7.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.799 0.809 . . . . 0.0 109.158 175.826 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -148.53 95.5 2.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.8 1.24 . . . . 0.0 107.747 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -93.92 102.58 14.68 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.419 -178.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.0 mm -101.75 104.83 16.94 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.605 -166.505 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 18' ' ' TYR . 7.6 t -60.04 92.95 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 160.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 32.23 -62.23 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 128.772 2.829 . . . . 0.0 115.502 166.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 16' ' ' CYS . 3.2 t80 -134.67 -41.9 0.77 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.616 0.767 . . . . 0.0 110.155 -175.663 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -97.79 34.59 1.85 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.181 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.37 122.54 26.52 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.783 0.433 . . . . 0.0 111.126 159.267 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -69.37 -53.01 21.67 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 168.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -174.69 125.8 0.29 Allowed 'General case' 0 C--N 1.362 1.141 0 C-N-CA 123.926 0.89 . . . . 0.0 109.868 163.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -96.82 146.49 24.87 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -67.05 -29.81 69.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.946 0.499 . . . . 0.0 111.164 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -162.59 158.21 23.07 Favored 'General case' 0 CA--C 1.557 1.241 0 CA-C-O 120.993 0.425 . . . . 0.0 111.158 -173.426 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.8 p -65.25 -31.06 72.02 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -74.42 -36.7 63.46 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.359 0.527 . . . . 0.0 111.043 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -58.72 -48.29 81.65 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.697 1.237 . . . . 0.0 109.606 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.23 -43.53 78.7 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.801 -2.0 . . . . 0.0 112.383 169.86 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -57.9 -29.42 65.07 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.801 0.84 . . . . 0.0 112.679 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.476 ' HA ' ' HB ' ' A' ' 50' ' ' THR . 61.1 t -61.05 -46.82 95.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.488 0.715 . . . . 0.0 110.532 176.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -73.81 -39.61 63.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.86 0.864 . . . . 0.0 111.069 174.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 43.0 ttt180 -69.35 -1.93 9.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.685 1.194 . . . . 0.0 111.965 -173.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.543 ' SD ' ' NE2' ' A' ' 43' ' ' GLN . 24.9 ptt? -45.38 -16.5 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.985 1.714 . . . . 0.0 114.79 174.156 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -86.77 -56.89 4.75 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.706 0 C-N-CA 125.379 1.471 . . . . 0.0 110.046 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.83 6.43 36.59 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -172.003 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.616 HG23 ' HD3' ' A' ' 41' ' ' PRO . 5.2 t -62.15 -49.66 74.97 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -169.212 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.28 -30.33 3.71 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 119.917 -0.38 . . . . 0.0 112.735 -169.885 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -70.03 -16.47 63.16 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.087 0.955 . . . . 0.0 113.217 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . 0.573 ' HZ1' ' HB2' ' A' ' 40' ' ' LYS . 0.0 OUTLIER 45.08 82.14 0.24 Allowed Pre-proline 0 CA--C 1.563 1.476 0 C-N-CA 125.279 1.431 . . . . 0.0 112.706 -176.745 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . 0.616 ' HD3' HG23 ' A' ' 37' ' ' THR . 2.1 Cg_endo -83.3 173.58 9.7 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.292 2.661 . . . . 0.0 110.482 172.291 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 mp -97.92 131.37 44.44 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -173.669 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' SD ' ' A' ' 34' ' ' MET . 33.4 tt0 -120.32 141.42 50.04 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.733 0.413 . . . . 0.0 110.503 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.587 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.7 t -64.65 108.53 1.73 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.645 0.778 . . . . 0.0 109.573 169.724 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.83 6.28 2.66 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.32 1.048 . . . . 0.0 112.644 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.587 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 mp -90.73 -51.59 11.6 Favored 'Isoleucine or valine' 0 C--N 1.354 0.802 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -174.149 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 25.0 p -119.94 -112.75 0.33 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.36 158.27 27.66 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 108.253 -1.939 . . . . 0.0 108.253 157.026 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.421 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.7 t80 172.04 110.46 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 102.216 -3.253 . . . . 0.0 102.216 -175.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.476 ' HB ' ' HA ' ' A' ' 31' ' ' VAL . 2.7 m -119.64 137.12 54.08 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -167.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.501 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 8.1 p -160.11 155.93 25.96 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.994 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 2.68 45.05 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.515 175.044 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -105.21 103.99 13.63 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 124.548 1.139 . . . . 0.0 108.345 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -50.73 -45.36 58.61 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.373 0.669 . . . . 0.0 111.268 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.65 -39.78 68.37 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.424 1.077 . . . . 0.0 112.783 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.501 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 22.9 t -61.47 -54.9 37.34 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.231 0.612 . . . . 0.0 111.79 -174.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -75.14 -35.91 61.63 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.793 179.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -50.66 -41.63 55.68 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.021 0.929 . . . . 0.0 112.733 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.432 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 93.7 m95 -80.67 -54.53 5.55 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.399 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -41.28 -46.63 3.26 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.462 ' HE1' HD11 ' A' ' 46' ' ' ILE . 23.4 ptm -61.52 -46.97 87.7 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 179.024 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -68.42 -36.58 79.28 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.489 0.661 . . . . 0.0 111.522 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.432 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 29.4 mmmt -67.05 -33.94 76.6 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.017 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 67' ' ' ASP . 0.2 OUTLIER -106.88 4.4 27.32 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 179.293 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.1 -43.36 87.47 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.28 15.06 30.0 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.509 175.05 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.511 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 6.0 p-10 33.59 46.19 0.11 Allowed 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 126.135 1.774 . . . . 0.0 114.172 -174.356 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.47 ' HA ' ' HB2' ' A' ' 73' ' ' SER . 19.9 m -62.59 -24.31 67.49 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.724 0.809 . . . . 0.0 113.132 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -93.7 -4.6 50.22 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.58 0.752 . . . . 0.0 112.383 178.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -65.21 -80.8 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -104.54 -85.97 0.46 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 166.258 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.506 ' HB2' ' O ' ' A' ' 81' ' ' PHE . 64.4 m-85 -159.45 134.49 8.13 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' SER . . . . . 0.47 ' HB2' ' HA ' ' A' ' 68' ' ' SER . 38.1 m -142.81 162.8 34.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.532 0.682 . . . . 0.0 111.446 -176.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 6.6 t -103.72 118.1 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 167.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.56 -22.81 66.73 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.047 0.385 . . . . 0.0 111.377 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mt -84.24 -41.73 16.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 122.78 0.432 . . . . 0.0 111.499 -172.403 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.7 p -136.92 -0.61 2.28 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.3 39.15 96.83 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 114.613 0.605 . . . . 0.0 114.613 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -64.49 -38.0 89.49 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.016 0.526 . . . . 0.0 111.212 -176.193 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 74.64 114.81 0.06 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.449 1.499 . . . . 0.0 110.014 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.506 ' O ' ' HB2' ' A' ' 72' ' ' PHE . 91.6 m-85 -122.19 163.63 19.23 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.302 0.641 . . . . 0.0 109.937 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.99 -1.4 52.47 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -158.62 144.67 16.89 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.671 0.788 . . . . 0.0 108.919 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -58.22 -27.52 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.459 1.104 . . . . 0.0 110.937 174.542 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -54.54 -44.7 73.06 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.544 0.738 . . . . 0.0 110.813 173.891 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -70.24 -29.04 65.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.509 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.27 -45.35 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 123.972 0.909 . . . . 0.0 110.494 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 88.5 t -71.44 -37.6 65.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.341 1.056 . . . . 0.0 109.147 -176.497 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.63 78.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.847 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -72.13 -33.89 68.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.449 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -73.59 -33.28 64.54 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.349 0.595 . . . . 0.0 109.482 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.58 71.54 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.016 174.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -87.96 -58.77 2.45 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-O 121.473 0.654 . . . . 0.0 111.448 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.5 t -91.78 -8.18 47.48 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.878 1.271 . . . . 0.0 111.554 -167.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -136.17 54.15 9.15 Favored Pre-proline 0 CA--C 1.564 1.514 0 C-N-CA 123.112 0.565 . . . . 0.0 111.084 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.99 -27.81 20.13 Favored 'Trans proline' 0 C--N 1.383 2.375 0 C-N-CA 121.978 1.786 . . . . 0.0 112.42 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -139.65 100.18 3.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.189 0.996 . . . . 0.0 109.161 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 77.0 t . . . . . 0 C--O 1.253 1.253 0 C-N-CA 123.959 0.904 . . . . 0.0 108.678 172.412 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.4 m80 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.1 91.63 0.07 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.021 0.826 . . . . 0.0 111.126 -176.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -169.23 48.02 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -127.15 89.38 2.96 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -174.167 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . 0.428 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 63.0 m-85 -93.09 113.75 26.09 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.197 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.648 HG21 ' H ' ' A' ' 17' ' ' GLU . 9.5 mm -119.69 158.67 21.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 124.562 1.145 . . . . 0.0 108.491 -170.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.581 ' H ' ' HB2' ' A' ' 20' ' ' ALA . 48.9 t -104.39 -10.03 18.04 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.828 0.851 . . . . 0.0 110.572 176.948 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.648 ' H ' HG21 ' A' ' 15' ' ' ILE . 3.1 mp0 88.65 -16.49 0.3 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.745 2.018 . . . . 0.0 112.391 170.131 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -134.86 -51.54 0.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.319 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.9 p -122.67 74.2 1.18 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.698 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.581 ' HB2' ' H ' ' A' ' 16' ' ' CYS . . . -164.13 146.23 8.99 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.58 0.705 . . . . 0.0 112.229 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -77.9 -171.26 2.2 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 113.831 -1.531 . . . . 0.0 108.979 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.61 125.24 30.96 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.46 ' HB3' ' HB2' ' A' ' 28' ' ' ASN . 67.9 m-85 -110.23 147.54 33.58 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.058 0.543 . . . . 0.0 110.654 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -58.62 -37.22 75.43 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.119 0.968 . . . . 0.0 112.38 175.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.6 t -147.59 156.05 42.42 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.061 0.458 . . . . 0.0 111.103 -167.814 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.2 p -57.02 -27.08 61.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.662 -1.153 . . . . 0.0 111.551 171.282 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 36.7 t60 -70.99 -41.04 71.49 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.945 0.498 . . . . 0.0 110.625 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.46 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 2.3 m-20 -60.75 -49.62 76.78 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.021 0.915 . . . . 0.0 110.209 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 tp -63.83 -35.56 81.02 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.45 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.95 -31.98 71.52 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 123.444 0.697 . . . . 0.0 112.443 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.469 HG12 ' HB ' ' A' ' 50' ' ' THR . 79.0 t -64.08 -49.4 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.658 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -60.07 -39.18 85.17 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.773 0.829 . . . . 0.0 110.913 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -67.13 2.09 1.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.07 1.348 . . . . 0.0 111.73 -175.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.9 ptp -44.97 -22.95 0.11 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.58 1.552 . . . . 0.0 113.482 172.897 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.11 -50.59 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.772 1.229 . . . . 0.0 110.042 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -98.26 6.44 47.4 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.162 0.585 . . . . 0.0 111.638 -171.421 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -58.84 -60.19 4.23 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -164.59 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.48 -32.19 0.99 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 122.929 0.3 . . . . 0.0 113.335 -168.899 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.17 -42.83 75.37 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.749 1.219 . . . . 0.0 110.16 171.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 68.4 100.76 0.04 OUTLIER Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.729 1.611 . . . . 0.0 111.091 -171.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.87 -162.81 0.11 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.815 2.343 . . . . 0.0 111.603 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.417 HD11 ' N ' ' A' ' 54' ' ' LYS . 43.7 mt -100.01 106.34 18.11 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.221 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -132.33 135.51 46.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.539 0.736 . . . . 0.0 110.236 -169.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 1.2 t -65.32 107.79 1.73 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.108 0.963 . . . . 0.0 110.805 178.824 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -87.96 56.38 3.85 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.899 0.857 . . . . 0.0 110.811 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mm -125.93 -54.35 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 164.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.5 p -119.37 -116.99 0.32 Allowed 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 176.359 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -146.15 164.07 28.33 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 155.016 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 8.1 t80 171.25 113.1 0.01 OUTLIER 'General case' 0 C--N 1.348 0.511 0 N-CA-C 101.794 -3.41 . . . . 0.0 101.794 -174.204 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.469 ' HB ' HG12 ' A' ' 31' ' ' VAL . 8.0 m -121.75 129.5 52.74 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -170.206 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.6 t -141.01 163.12 33.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.637 -175.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -76.47 -21.04 56.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.493 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -117.76 116.23 26.6 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.483 1.113 . . . . 0.0 109.636 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.417 ' N ' HD11 ' A' ' 42' ' ' LEU . 63.4 tttm -57.61 -34.77 69.62 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.142 0.977 . . . . 0.0 111.801 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.65 70.97 Favored 'General case' 0 CA--C 1.554 1.122 0 O-C-N 123.846 0.716 . . . . 0.0 112.301 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -61.85 -55.27 31.63 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.745 0.418 . . . . 0.0 111.3 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.405 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -71.26 -27.93 63.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.133 0.573 . . . . 0.0 111.687 178.844 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -52.58 -44.12 65.72 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.721 0.808 . . . . 0.0 112.396 171.396 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -76.72 -45.83 27.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.405 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 63.8 t60 -45.94 -40.93 10.92 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 168.14 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.412 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 66.8 mtm -71.82 -37.4 70.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.384 -0.823 . . . . 0.0 112.624 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -56.89 -32.15 65.59 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 168.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -67.96 -42.39 81.0 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.4 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.412 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 84.7 m-70 -56.98 -35.81 69.61 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.235 0.614 . . . . 0.0 111.389 171.541 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.12 -11.65 60.84 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.03 0.532 . . . . 0.0 110.277 -174.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.8 -4.01 19.78 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.972 0.909 . . . . 0.0 112.226 -177.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -156.61 -41.92 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 119.607 1.094 . . . . 0.0 113.368 -174.635 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 t -64.57 -10.33 25.4 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -165.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -122.37 7.75 9.62 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.862 -0.524 . . . . 0.0 109.872 -170.47 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -142.42 -35.21 0.43 Allowed 'General case' 0 C--N 1.361 1.104 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.23 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -82.19 -55.71 4.38 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.48 0.312 . . . . 0.0 111.148 -164.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -143.87 131.24 20.92 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.5 p -161.38 123.46 2.99 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 175.398 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.42 115.58 7.21 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -61.24 -19.25 61.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.182 0.593 . . . . 0.0 111.707 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 mt -96.12 -42.97 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.232 0 C-N-CA 123.62 0.768 . . . . 0.0 112.149 -175.432 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . 0.595 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.8 p -135.29 -5.11 2.33 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.44 1.018 . . . . 0.0 113.24 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.57 32.25 77.57 Favored Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.102 0.382 . . . . 0.0 113.873 176.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.595 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 52.9 tttm -69.89 -15.8 63.13 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -170.243 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt 76.13 112.68 0.07 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 124.52 1.128 . . . . 0.0 111.933 167.13 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -133.87 148.62 51.28 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.598 0.759 . . . . 0.0 111.847 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.57 -18.48 65.02 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.907 1.283 . . . . 0.0 113.821 -174.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.56 ' HZ1' ' HB3' ' A' ' 83' ' ' LYS . 0.3 OUTLIER -144.84 148.31 33.85 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.851 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.46 -29.99 71.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.658 0.783 . . . . 0.0 110.288 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -56.6 -41.67 77.42 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.295 170.736 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.427 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 43.3 t -69.02 -30.42 68.79 Favored 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 122.951 0.5 . . . . 0.0 110.944 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.56 -44.49 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.737 0.815 . . . . 0.0 109.745 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -74.13 -36.35 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.141 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.22 -40.44 94.11 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.936 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.97 -29.64 66.8 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.765 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -72.09 -40.79 67.98 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.466 0.65 . . . . 0.0 109.77 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.0 63.08 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.637 178.202 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -98.78 -51.69 3.82 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.373 1.069 . . . . 0.0 112.029 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.3 t -92.85 -14.03 28.26 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.858 1.263 . . . . 0.0 111.405 -169.84 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.601 ' HB3' HG22 ' A' ' 98' ' ' VAL . 64.4 m-70 -131.37 56.16 22.97 Favored Pre-proline 0 CA--C 1.556 1.199 0 C-N-CA 122.835 0.454 . . . . 0.0 110.956 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.38 -32.19 26.35 Favored 'Trans proline' 0 C--N 1.387 2.57 0 C-N-CA 122.002 1.802 . . . . 0.0 111.282 175.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -127.35 99.3 5.59 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 173.065 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.601 HG22 ' HB3' ' A' ' 95' ' ' HIS . 41.4 t . . . . . 0 C--O 1.252 1.195 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.464 177.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t60 . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.7 ttp -136.12 -47.66 0.65 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.485 0.714 . . . . 0.0 110.069 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -122.39 51.63 1.37 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -125.92 83.92 2.22 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.514 -1.221 . . . . 0.0 107.909 -173.942 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -81.93 115.3 21.04 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.9 -1.5 . . . . 0.0 110.024 -175.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 15.4 mm -105.31 137.49 34.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -175.527 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.582 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 43.5 t -80.93 -24.73 37.96 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.211 0.604 . . . . 0.0 110.256 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 117.5 -28.63 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 127.728 2.411 . . . . 0.0 110.541 167.05 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -133.06 -42.4 0.89 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.114 0.966 . . . . 0.0 108.587 -173.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 66.76 1.01 Allowed 'General case' 0 C--O 1.242 0.68 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.242 -178.386 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.582 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.04 124.2 1.5 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.989 162.095 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -67.74 -52.73 34.01 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 169.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -178.05 132.11 0.15 Allowed 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.393 1.477 . . . . 0.0 108.575 163.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -100.17 135.2 41.96 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 170.996 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -73.79 -10.99 60.23 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.262 0.625 . . . . 0.0 111.375 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -146.91 134.99 21.54 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 122.751 0.42 . . . . 0.0 110.833 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' SER . . . . . 0.619 ' HA ' HD22 ' A' ' 29' ' ' LEU . 20.1 m -59.82 -34.82 73.57 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.432 1.093 . . . . 0.0 111.588 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -62.36 -44.81 95.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.045 0.938 . . . . 0.0 110.748 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -66.89 -42.53 85.35 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.739 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.619 HD22 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -62.68 -34.87 78.01 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.439 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.67 69.16 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 123.754 0.659 . . . . 0.0 111.985 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.416 HG22 ' HD3' ' A' ' 52' ' ' ARG . 39.6 t -63.92 -47.76 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.74 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -62.87 -39.9 95.85 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.194 0.998 . . . . 0.0 110.534 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.425 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 41.8 ttt180 -68.62 5.94 0.95 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.41 1.084 . . . . 0.0 111.842 -173.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.6 ptp -42.87 -20.8 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 126.512 1.925 . . . . 0.0 114.853 176.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.32 -58.46 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 108.637 178.676 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.425 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.54 10.52 37.03 Favored 'General case' 0 N--CA 1.501 2.113 0 C-N-CA 124.458 1.103 . . . . 0.0 113.137 -170.345 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.418 ' OG1' ' HB2' ' A' ' 39' ' ' GLU . 4.5 t -57.8 -65.12 0.69 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -164.485 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.67 36.4 91.24 Favored Glycine 0 N--CA 1.476 1.357 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.418 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 37.1 mt-10 -149.86 -34.77 0.17 Allowed 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.902 1.681 . . . . 0.0 107.781 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt 46.77 75.93 0.61 Allowed Pre-proline 0 C--N 1.371 1.539 0 C-N-CA 126.263 1.825 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.36 -74.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.382 2.33 0 C-N-CA 123.107 2.538 . . . . 0.0 111.842 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . 0.446 ' HB2' ' O ' ' A' ' 51' ' ' CYS . 95.4 mt -145.49 98.94 3.22 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.435 ' HG2' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -129.85 141.76 50.78 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -168.444 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.6 t -66.1 102.9 0.87 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -73.97 -1.47 19.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.828 0.851 . . . . 0.0 111.945 177.969 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.492 HD12 ' SD ' ' A' ' 61' ' ' MET . 3.4 mp -83.8 -55.6 6.91 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 N-CA-C 107.103 -1.444 . . . . 0.0 107.103 174.551 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 18.3 p -132.58 -97.92 0.3 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.396 176.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.476 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -155.46 131.19 3.0 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 116.906 -2.052 . . . . 0.0 109.078 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.0 t80 164.83 113.56 0.01 OUTLIER 'General case' 0 C--N 1.354 0.804 0 N-CA-C 102.402 -3.184 . . . . 0.0 102.402 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.435 ' OG1' ' HG2' ' A' ' 43' ' ' GLN . 3.1 m -128.42 126.51 40.72 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.446 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 96.4 m -150.45 141.74 23.25 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.442 -175.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.416 ' HD3' HG22 ' A' ' 31' ' ' VAL . 29.9 ptt180 -69.66 -12.19 61.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.588 0.755 . . . . 0.0 111.147 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -101.02 107.76 19.3 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.35 -41.77 29.51 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.127 1.371 . . . . 0.0 111.65 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.87 -29.48 59.99 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.68 -1.145 . . . . 0.0 113.023 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.2 m -69.41 -56.34 7.74 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.134 -0.354 . . . . 0.0 111.816 179.354 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -75.68 -48.49 21.78 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.215 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -55.89 -31.38 62.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.446 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 27.2 m95 -83.98 -39.59 19.53 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.305 178.12 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -45.88 -37.86 6.76 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.492 ' SD ' HD12 ' A' ' 46' ' ' ILE . 23.0 ttp -62.61 -47.03 85.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.754 0.822 . . . . 0.0 111.252 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.75 -36.97 80.26 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.538 0.735 . . . . 0.0 111.24 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 64.2 mttm -62.58 -33.94 75.97 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.624 0.769 . . . . 0.0 111.255 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.451 ' HB2' ' HA ' ' A' ' 67' ' ' ASP . 3.1 p80 -107.56 23.69 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -53.37 -34.71 58.71 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 121.19 0.519 . . . . 0.0 110.097 157.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.04 -30.04 28.37 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.991 0.916 . . . . 0.0 111.682 173.765 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . 0.451 ' HA ' ' HB2' ' A' ' 64' ' ' HIS . 17.7 m-20 84.34 -55.91 0.12 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 126.651 1.98 . . . . 0.0 113.758 170.958 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.9 p -45.04 -34.62 2.6 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -166.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -104.69 0.08 28.0 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -171.754 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.446 ' HB2' ' HB3' ' A' ' 64' ' ' HIS . 54.2 m-85 -150.27 32.35 0.66 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.492 0.717 . . . . 0.0 111.41 -174.428 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . 0.404 ' HG3' ' O ' ' A' ' 67' ' ' ASP . 39.2 mt-30 -86.17 -21.14 27.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.384 0.274 . . . . 0.0 110.487 172.792 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -140.69 131.56 25.96 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 104.51 -2.404 . . . . 0.0 104.51 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -158.36 153.94 26.2 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 123.53 0.732 . . . . 0.0 110.359 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.2 t -89.12 118.81 29.11 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 105.944 -1.872 . . . . 0.0 105.944 168.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.41 -19.81 65.9 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-O 121.024 0.44 . . . . 0.0 111.501 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -88.15 -37.32 10.39 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.279 0 C-N-CA 123.029 0.532 . . . . 0.0 111.785 -173.574 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.3 p -150.33 17.07 0.83 Allowed 'General case' 0 C--N 1.377 1.778 0 CA-C-N 119.449 1.022 . . . . 0.0 113.393 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 49.35 46.48 35.81 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 117.286 1.675 . . . . 0.0 117.286 160.77 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.68 -45.1 88.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 117.313 0.557 . . . . 0.0 111.241 173.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.517 ' HB2' ' HZ1' ' A' ' 80' ' ' LYS . 0.2 OUTLIER 69.07 112.72 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.484 1.114 . . . . 0.0 109.447 -167.813 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -111.32 167.89 9.95 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.209 1.004 . . . . 0.0 110.625 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.29 -31.51 71.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.179 0.592 . . . . 0.0 112.473 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.7 155.59 47.28 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.068 0.461 . . . . 0.0 110.403 177.872 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -62.43 -31.14 71.8 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.305 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -59.28 -38.54 80.4 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.513 0.725 . . . . 0.0 110.592 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 67.6 m -70.28 -29.63 66.44 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 122.764 0.426 . . . . 0.0 111.571 176.06 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.06 -43.8 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.422 0.689 . . . . 0.0 109.688 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 80.6 t -71.57 -38.26 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.955 1.302 . . . . 0.0 109.239 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.01 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.71 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -72.32 -40.91 67.13 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.479 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -70.69 -38.6 73.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.77 0.828 . . . . 0.0 109.362 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.62 -28.81 68.05 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.451 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -91.62 -45.07 8.67 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.872 0.869 . . . . 0.0 111.207 -173.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.5 t -94.08 -23.35 18.01 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.746 1.219 . . . . 0.0 111.191 -169.507 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 -129.37 50.47 5.97 Favored Pre-proline 0 CA--C 1.569 1.677 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -79.48 -37.96 0.45 Allowed 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 121.67 1.58 . . . . 0.0 111.45 167.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -104.5 96.91 6.92 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 176.409 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 CA--C 1.555 1.162 0 CA-C-N 114.776 -1.102 . . . . 0.0 108.38 170.808 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 121.321 0.581 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.1 ttm -171.21 -45.91 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.599 1.16 . . . . 0.0 107.966 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -149.41 37.12 0.75 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.906 173.954 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.66 80.98 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -169.267 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -81.97 104.23 12.18 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.842 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -113.38 157.59 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 124.286 1.034 . . . . 0.0 109.777 -171.046 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.9 t -119.75 37.15 4.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.267 1.427 . . . . 0.0 108.149 -173.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 53.17 -37.46 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 127.827 2.451 . . . . 0.0 117.144 -172.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -133.86 -48.84 0.81 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.899 0.88 . . . . 0.0 110.629 -167.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -113.5 29.98 7.58 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.954 -168.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.29 142.11 46.22 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.89 0.852 . . . . 0.0 111.825 167.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.9 ptp180 -72.54 -114.53 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 113.363 -1.744 . . . . 0.0 108.178 164.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -137.2 124.41 21.75 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 161.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -109.1 136.6 48.33 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -87.98 0.71 55.57 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 t -146.26 140.4 26.48 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 122.885 0.474 . . . . 0.0 110.126 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.0 m -46.09 -56.77 5.16 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.361 1.465 . . . . 0.0 113.266 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.44 ' O ' HG21 ' A' ' 31' ' ' VAL . 93.5 m-70 -69.34 -33.54 73.26 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.677 0.791 . . . . 0.0 111.776 -175.286 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -51.32 -55.37 18.73 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.063 0.945 . . . . 0.0 111.446 175.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.38 -45.7 87.79 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 114.889 -1.05 . . . . 0.0 112.187 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.66 -27.52 50.37 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.606 0.763 . . . . 0.0 112.785 178.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.44 HG21 ' O ' ' A' ' 27' ' ' HIS . 63.1 t -64.98 -51.14 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.358 0.663 . . . . 0.0 110.417 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -61.57 -40.11 93.55 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.382 0.673 . . . . 0.0 109.831 175.592 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.423 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 39.4 ttt180 -67.26 4.71 0.88 Allowed 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.622 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -45.46 -17.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 125.708 1.603 . . . . 0.0 114.957 174.156 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.99 -59.69 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.43 0 C-N-CA 125.128 1.371 . . . . 0.0 109.213 176.233 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.423 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -102.05 9.35 40.43 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.132 0.973 . . . . 0.0 112.98 -171.065 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.5 t -58.53 -56.39 22.7 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.89 0.876 . . . . 0.0 113.247 -170.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.18 -32.07 3.08 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 119.835 -0.425 . . . . 0.0 112.544 -170.116 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.13 -37.27 69.49 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 123.729 0.812 . . . . 0.0 111.306 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 68.02 110.35 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.927 1.291 . . . . 0.0 111.599 -170.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.84 -164.65 0.28 Allowed 'Trans proline' 0 C--N 1.383 2.354 0 C-N-CA 122.551 2.167 . . . . 0.0 110.352 165.415 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.6 mt -117.12 104.25 11.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.233 0.613 . . . . 0.0 109.48 -177.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . 0.479 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 24.3 tm0? -127.25 141.39 51.74 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.682 0.793 . . . . 0.0 109.077 -168.095 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 t -69.49 107.98 3.59 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.612 0.765 . . . . 0.0 111.648 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -55.93 -27.54 52.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.73 1.212 . . . . 0.0 113.312 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.18 -57.51 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 122.736 0.414 . . . . 0.0 109.919 -174.84 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.5 p -129.45 -88.44 0.51 Allowed 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -154.08 145.9 13.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 116.997 -2.002 . . . . 0.0 108.781 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.479 ' O ' ' HA ' ' A' ' 43' ' ' GLN . 20.1 t80 165.5 110.91 0.01 OUTLIER 'General case' 0 C--N 1.358 0.954 0 N-CA-C 102.302 -3.221 . . . . 0.0 102.302 166.988 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -118.85 136.3 54.1 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -174.536 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.519 ' SG ' HD21 ' A' ' 57' ' ' LEU . 25.7 p -157.33 -173.99 4.68 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.759 -176.513 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.423 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.75 13.38 7.43 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.739 0.815 . . . . 0.0 109.029 172.215 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -121.63 104.94 9.99 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.652 1.181 . . . . 0.0 108.303 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -55.97 -31.78 63.31 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.439 1.096 . . . . 0.0 112.918 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.03 -43.08 91.58 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.49 1.119 . . . . 0.0 111.903 174.503 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -61.25 -55.89 26.87 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.452 0.701 . . . . 0.0 112.187 -171.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.519 HD21 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -75.4 -27.37 59.03 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.576 178.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -50.21 -44.97 53.4 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -80.79 -37.77 29.66 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 122.358 -0.214 . . . . 0.0 110.596 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.401 ' HA ' ' HD3' ' A' ' 63' ' ' LYS . 83.1 t60 -48.5 -43.12 34.77 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.9 ptm -72.66 -33.84 66.84 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 119.218 0.917 . . . . 0.0 112.285 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -28.01 64.61 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.403 0.681 . . . . 0.0 111.183 168.1 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.401 ' HD3' ' HA ' ' A' ' 60' ' ' HIS . 28.6 mtpp -72.39 -36.79 68.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.451 0.7 . . . . 0.0 110.364 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 -66.64 -24.73 66.34 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.507 0.723 . . . . 0.0 111.437 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -56.08 -29.13 60.09 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.731 0.812 . . . . 0.0 112.578 -171.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.64 -54.17 2.51 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 167.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -51.56 -41.29 61.02 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -165.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.3 p -59.49 -69.62 0.2 Allowed 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.886 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -138.43 -21.71 1.03 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.951 0.9 . . . . 0.0 110.62 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -94.65 45.03 1.11 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.58 1.152 . . . . 0.0 108.466 -170.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -97.61 0.31 47.06 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 114.44 -1.254 . . . . 0.0 110.948 -161.24 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.472 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 66.4 m-85 -137.03 136.95 38.88 Favored 'General case' 0 C--N 1.343 0.314 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -171.751 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.5 p -159.92 129.57 5.3 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.435 1.094 . . . . 0.0 108.093 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . 0.434 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 6.2 t -67.39 122.91 18.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 169.518 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -53.51 -26.86 22.6 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -174.665 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . 0.403 HG21 HG21 ' A' ' 98' ' ' VAL . 7.8 mt -109.42 -25.94 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.566 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -171.814 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 p -140.37 5.23 2.04 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-N 120.474 1.488 . . . . 0.0 113.258 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 51.88 42.86 54.27 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 114.695 0.638 . . . . 0.0 114.695 174.073 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.434 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 3.8 tmtp? -65.51 -39.01 91.34 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -176.093 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.472 ' HG3' ' O ' ' A' ' 72' ' ' PHE . 0.0 OUTLIER 76.58 122.59 0.05 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 125.065 1.346 . . . . 0.0 111.408 -174.754 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.4 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.5 m-85 -135.68 148.62 48.99 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.123 1.369 . . . . 0.0 108.444 176.548 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.8 -19.27 65.71 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -174.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.35 140.7 47.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 124.418 1.087 . . . . 0.0 108.14 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.452 ' HB3' ' HZ1' ' A' ' 84' ' ' LYS . 8.5 mtpm? -58.88 -27.85 65.58 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.266 1.026 . . . . 0.0 110.653 175.443 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -56.88 -47.14 81.14 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.346 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.7 m -67.43 -27.68 67.26 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 122.431 0.292 . . . . 0.0 111.702 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t -71.22 -44.5 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.425 0.69 . . . . 0.0 110.098 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 79.5 t -73.78 -38.18 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.846 1.258 . . . . 0.0 109.592 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.01 96.23 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.521 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -73.32 -38.56 65.76 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.073 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . 0.561 ' HB3' ' HZ3' ' A' ' 91' ' ' LYS . 6.3 ttpm? -72.57 -37.71 68.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.963 0.505 . . . . 0.0 110.947 -169.13 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.74 -30.39 69.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.103 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -90.15 -46.31 8.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.835 0.854 . . . . 0.0 111.643 -171.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 42.4 t -88.16 -19.04 27.48 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.463 1.105 . . . . 0.0 110.652 -172.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -139.52 59.21 13.61 Favored Pre-proline 0 CA--C 1.557 1.225 0 C-N-CA 123.649 0.78 . . . . 0.0 109.246 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.48 -40.17 69.09 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 122.532 2.155 . . . . 0.0 112.875 -176.019 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -139.81 97.68 3.31 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.541 0.736 . . . . 0.0 110.178 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . 0.403 HG21 HG21 ' A' ' 76' ' ' ILE . 98.1 t . . . . . 0 N--CA 1.482 1.144 0 C-N-CA 124.031 0.932 . . . . 0.0 108.63 169.542 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.33 0.109 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.5 tpt -152.05 99.56 2.55 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.878 0.871 . . . . 0.0 109.066 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.4 33.71 0.24 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.499 ' HA ' ' HB3' ' A' ' 22' ' ' ALA . 15.8 m-20 -121.99 86.09 2.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.52 -162.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -93.64 111.6 23.31 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.498 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.409 ' HA ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 mm -108.35 145.67 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.558 -167.28 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.532 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 39.2 t -98.64 44.29 1.04 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 55.86 -40.53 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.226 2.61 . . . . 0.0 115.822 -172.373 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -134.94 -43.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.991 1.316 . . . . 0.0 109.414 -165.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -117.69 53.61 0.93 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.696 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.532 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -154.22 127.49 8.46 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.992 158.444 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -58.44 3.94 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 171.737 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.499 ' HB3' ' HA ' ' A' ' 13' ' ' ASP . . . -170.47 127.37 0.79 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.38 0.672 . . . . 0.0 110.867 164.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.66 157.72 16.75 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.443 0.697 . . . . 0.0 109.13 171.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -59.59 -36.08 75.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.156 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.2 m -145.75 155.85 43.22 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.223 0.535 . . . . 0.0 111.068 -176.106 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 p -59.03 -34.51 71.99 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.979 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -73.74 -33.16 64.21 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.269 0.628 . . . . 0.0 110.601 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.15 -50.94 69.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.278 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.415 HD11 ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -63.49 -33.14 74.92 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.374 0.67 . . . . 0.0 111.406 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.443 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -53.75 -27.51 28.99 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.425 1.078 . . . . 0.0 112.198 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 89.6 t -64.61 -48.06 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.864 0.865 . . . . 0.0 111.347 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.88 -37.84 82.28 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.642 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 52.4 ttt85 -62.64 -3.43 1.49 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.718 1.607 . . . . 0.0 112.615 -177.436 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 20.8 ptt? -45.06 -16.19 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.4 tp -85.51 -51.3 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 C-N-CA 125.358 1.463 . . . . 0.0 110.027 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.62 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -104.6 11.71 33.9 Favored 'General case' 0 N--CA 1.508 2.472 0 C-N-CA 125.158 1.383 . . . . 0.0 112.996 -178.311 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.642 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 7.1 t -57.95 -55.05 39.88 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -161.193 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.05 36.69 91.08 Favored Glycine 0 N--CA 1.473 1.164 0 N-CA-C 112.025 -0.43 . . . . 0.0 112.025 -171.982 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.404 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 33.7 mt-10 -158.82 -58.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -168.641 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 76.58 97.45 0.04 OUTLIER Pre-proline 0 C--N 1.352 0.708 0 C-N-CA 126.824 2.05 . . . . 0.0 111.504 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.33 172.16 12.71 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 122.508 2.139 . . . . 0.0 110.915 164.481 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -89.34 138.51 31.37 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -139.39 136.79 35.08 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.242 0.339 . . . . 0.0 110.277 -171.389 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.536 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 3.9 t -70.56 106.39 3.45 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.875 0.87 . . . . 0.0 109.433 175.85 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.33 16.65 1.23 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.834 0.854 . . . . 0.0 112.646 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.536 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 3.5 mp -94.53 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.351 0.656 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.515 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 23.7 p -116.32 -108.38 0.37 Allowed 'General case' 0 C--O 1.24 0.571 0 N-CA-C 104.206 -2.516 . . . . 0.0 104.206 172.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.515 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.09 159.85 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 108.593 -1.803 . . . . 0.0 108.593 155.773 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.445 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 15.4 t80 174.08 111.16 0.02 OUTLIER 'General case' 0 C--N 1.353 0.737 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.0 m -119.73 135.25 54.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -171.54 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.8 t -157.31 157.96 35.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.728 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.464 ' HD2' ' N ' ' A' ' 53' ' ' GLN . 2.2 ppt_? -78.47 -21.82 48.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.526 -1.215 . . . . 0.0 111.677 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.464 ' N ' ' HD2' ' A' ' 52' ' ' ARG . 8.0 tp60 -98.62 115.84 29.52 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -174.87 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.592 ' HB3' ' HZ2' ' A' ' 54' ' ' LYS . 0.4 OUTLIER -55.22 -34.27 63.8 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 176.535 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.98 -41.43 71.19 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 124.266 0.979 . . . . 0.0 111.85 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.2 m -57.42 -56.48 21.31 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.274 0.63 . . . . 0.0 112.174 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.54 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 2.2 pt? -76.29 -27.62 56.7 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.048 0.539 . . . . 0.0 111.969 177.763 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -50.4 -46.79 56.47 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 123.616 0.766 . . . . 0.0 112.59 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -81.02 -46.06 15.62 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.54 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 78.6 t60 -45.53 -43.09 11.59 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.6 ptm -63.1 -39.76 95.64 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 118.667 0.667 . . . . 0.0 111.459 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.86 -24.92 64.4 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 122.827 0.451 . . . . 0.0 111.625 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.473 ' HD2' ' CD1' ' A' ' 69' ' ' PHE . 73.6 mmtt -63.3 -29.95 71.18 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.5 0.32 . . . . 0.0 110.693 171.857 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -70.62 -8.33 50.91 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 124.083 0.953 . . . . 0.0 112.106 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -60.57 -53.33 58.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.064 0.545 . . . . 0.0 110.027 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.14 -12.54 15.37 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.587 0.755 . . . . 0.0 111.761 174.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 55.9 43.83 26.81 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.103 0.961 . . . . 0.0 110.258 -170.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -72.05 -63.95 1.04 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.596 -1.184 . . . . 0.0 111.103 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . 0.539 ' HD2' ' HB3' ' A' ' 80' ' ' LYS . 92.1 m-85 -65.18 -6.14 8.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -71.34 -34.38 70.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.746 0.818 . . . . 0.0 110.298 168.573 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -113.16 12.17 18.99 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.635 1.174 . . . . 0.0 111.481 -173.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.426 ' CE2' ' HG3' ' A' ' 84' ' ' LYS . 23.6 m-85 -135.17 135.3 40.95 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 179.811 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.7 m -156.57 167.21 31.13 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.917 1.287 . . . . 0.0 109.91 178.271 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 36.2 t -96.68 124.09 40.56 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 162.601 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 14.7 p30 -62.45 -20.42 64.52 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.2 mt -104.11 -37.05 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.8 p -134.62 13.09 3.74 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 119.62 1.1 . . . . 0.0 113.007 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 50.36 32.83 23.04 Favored Glycine 0 C--N 1.358 1.753 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 171.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.3 tmtm? -63.69 -35.17 79.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.889 0.876 . . . . 0.0 112.57 -174.674 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.539 ' HB3' ' HD2' ' A' ' 69' ' ' PHE . 4.8 mptp? 75.09 115.61 0.06 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.384 1.074 . . . . 0.0 109.948 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 96.2 m-85 -124.22 154.6 39.92 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.769 0.827 . . . . 0.0 111.475 -177.458 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.43 -41.26 98.58 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.434 1.094 . . . . 0.0 111.354 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.491 ' HB2' ' H ' ' A' ' 86' ' ' SER . 35.4 mtpt -121.61 144.59 48.66 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 123.823 0.849 . . . . 0.0 108.747 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . 0.426 ' HG3' ' CE2' ' A' ' 72' ' ' PHE . 52.3 mtmt -65.03 -31.21 72.33 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.091 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . 0.422 ' HB3' ' HE2' ' A' ' 83' ' ' LYS . 33.1 t70 -54.61 -46.0 73.76 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.387 1.075 . . . . 0.0 110.578 170.047 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.491 ' H ' ' HB2' ' A' ' 83' ' ' LYS . 19.7 m -62.53 -32.44 73.38 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 123.336 0.397 . . . . 0.0 111.993 176.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 45.2 t -74.62 -45.03 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.128 0.571 . . . . 0.0 110.113 -175.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 99.3 t -70.92 -37.69 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.45 1.1 . . . . 0.0 109.29 -175.099 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.14 -38.43 82.16 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.673 -1.148 . . . . 0.0 109.511 177.302 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -73.06 -33.83 65.89 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.603 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -73.69 -45.75 50.45 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.199 0.599 . . . . 0.0 110.35 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.11 -21.0 66.33 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.672 0.789 . . . . 0.0 111.825 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -100.28 -49.96 4.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.995 0.918 . . . . 0.0 111.982 -175.217 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 28.6 t -99.81 -4.35 30.7 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.189 0.996 . . . . 0.0 111.427 -168.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . 0.408 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 54.0 m-70 -137.91 55.18 8.67 Favored Pre-proline 0 CA--C 1.568 1.651 0 C-N-CA 124.05 0.94 . . . . 0.0 110.804 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . 0.408 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 75.0 Cg_exo -54.78 -45.74 38.65 Favored 'Trans proline' 0 C--N 1.39 2.741 0 C-N-CA 123.161 2.574 . . . . 0.0 113.27 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -137.87 97.41 3.42 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 124.024 0.93 . . . . 0.0 109.737 -178.283 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.56 1.34 0 C-N-CA 124.755 1.222 . . . . 0.0 109.599 172.251 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.1 m80 . . . . . 0 N--CA 1.482 1.156 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 71.9 mtm -114.1 129.84 56.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.556 0.743 . . . . 0.0 109.873 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -89.49 16.38 7.75 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.219 1.009 . . . . 0.0 109.803 174.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.496 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 4.7 m-20 -134.72 93.72 3.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.704 1.202 . . . . 0.0 108.362 -167.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -79.36 113.59 17.62 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.244 1.418 . . . . 0.0 109.948 177.406 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.8 mt -109.6 134.04 52.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 C-N-CA 123.585 0.754 . . . . 0.0 110.338 -175.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.42 ' H ' ' HB1' ' A' ' 20' ' ' ALA . 9.9 t -80.16 103.01 9.74 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 159.813 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.97 -15.01 7.47 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.613 1.165 . . . . 0.0 112.834 -168.16 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.93 -40.16 5.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.005 0.522 . . . . 0.0 110.485 -171.385 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -141.8 48.84 1.6 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.356 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . 0.42 ' HB1' ' H ' ' A' ' 16' ' ' CYS . . . -155.54 148.28 24.21 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 163.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . 0.423 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 10.5 ptp180 -71.86 -72.49 0.22 Allowed 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.785 168.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . 0.496 ' HB1' ' HB3' ' A' ' 13' ' ' ASP . . . -171.15 154.63 4.1 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.234 1.013 . . . . 0.0 109.696 172.046 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -131.72 143.14 50.05 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.523 0.729 . . . . 0.0 109.335 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.17 -7.67 50.44 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.463 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.7 m -149.9 152.85 35.7 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.231 0.612 . . . . 0.0 110.395 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.0 t -61.5 -34.39 75.43 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.7 0.8 . . . . 0.0 111.726 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -73.28 -37.62 66.19 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.766 0.426 . . . . 0.0 110.788 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.59 -46.99 80.52 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.953 0.883 . . . . 0.0 109.927 173.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 tp -62.43 -39.12 92.27 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.592 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.549 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -54.33 -28.31 41.79 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.704 0.802 . . . . 0.0 112.496 176.529 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.0 t -63.73 -43.73 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.11 0.964 . . . . 0.0 111.185 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -70.5 -44.46 67.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.685 0.755 . . . . 0.0 110.391 170.339 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.549 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 49.7 ttp180 -70.87 4.43 2.58 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.059 -171.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' MET . . . . . 0.409 ' O ' HG22 ' A' ' 50' ' ' THR . 19.8 ptt? -44.82 -20.4 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.184 1.394 . . . . 0.0 114.079 170.976 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -47.13 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 125.434 1.494 . . . . 0.0 109.346 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -101.19 -11.34 19.61 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -172.94 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' THR . . . . . 0.419 ' HB ' ' O ' ' A' ' 33' ' ' ARG . 4.5 t -60.1 -41.88 93.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -152.277 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.8 39.6 89.87 Favored Glycine 0 C--N 1.347 1.17 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.646 -178.604 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.6 -80.74 0.52 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -171.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 164.05 93.54 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.336 1.854 . . . . 0.0 109.231 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -97.13 -155.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 124.044 3.162 . . . . 0.0 111.08 173.599 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.3 mt -93.28 83.25 4.58 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -118.97 136.06 54.29 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.745 -171.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.716 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 8.3 t -68.95 106.72 2.84 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.166 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -93.6 53.43 1.86 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.645 1.212 . . . . 0.0 108.056 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.716 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -134.28 -7.14 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 125.938 1.695 . . . . 0.0 108.978 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 13.1 p -178.68 -118.09 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 103.733 -2.691 . . . . 0.0 103.733 -168.158 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.69 134.68 4.84 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 161.347 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.8 t80 178.1 117.99 0.04 OUTLIER 'General case' 0 C--N 1.351 0.653 0 N-CA-C 102.481 -3.155 . . . . 0.0 102.481 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' THR . . . . . 0.409 HG22 ' O ' ' A' ' 34' ' ' MET . 6.8 m -124.57 147.4 48.47 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.213 0.915 . . . . 0.0 110.141 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.494 ' SG ' HD22 ' A' ' 57' ' ' LEU . 16.2 p -148.9 179.14 8.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.016 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . 0.492 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.35 23.4 6.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.135 1.374 . . . . 0.0 108.142 177.293 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -146.52 118.2 8.07 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.298 -167.087 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.454 ' HZ1' ' HB2' ' A' ' 54' ' ' LYS . 0.1 OUTLIER -53.83 -47.22 71.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.494 1.118 . . . . 0.0 113.094 -175.675 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.36 -33.25 70.94 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.0 m -63.65 -55.42 23.69 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.494 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -76.72 -26.35 54.55 Favored 'General case' 0 C--N 1.357 0.9 0 CA-C-N 118.09 0.405 . . . . 0.0 111.33 176.812 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.58 -49.61 72.28 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 173.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -79.19 -33.38 43.93 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.516 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 85.9 t60 -54.79 -38.51 67.39 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 167.096 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -31.25 62.57 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 120.127 1.33 . . . . 0.0 110.268 174.198 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . 0.496 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 26.2 ttpp -61.21 -27.78 68.68 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.411 0.684 . . . . 0.0 111.709 167.538 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.516 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 6.4 mmpt? -63.3 -44.64 94.44 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 123.155 0.582 . . . . 0.0 110.864 169.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -66.4 -30.8 71.25 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.306 0.643 . . . . 0.0 111.107 172.112 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . 0.496 ' HB3' ' HA ' ' A' ' 62' ' ' LYS . 22.4 t70 -79.82 -21.63 44.0 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.848 0.859 . . . . 0.0 109.09 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.3 75.01 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.938 0.895 . . . . 0.0 110.736 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.8 t70 81.73 -35.48 0.1 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.902 1.281 . . . . 0.0 111.479 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 p -70.24 -37.79 75.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.57 1.148 . . . . 0.0 111.645 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -61.82 -43.29 99.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.351 0.66 . . . . 0.0 110.629 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -94.62 65.09 3.09 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.198 0.999 . . . . 0.0 110.478 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -99.37 -37.91 9.04 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.292 169.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . 0.429 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 43.2 m-85 -148.77 133.9 18.26 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 105.083 -2.191 . . . . 0.0 105.083 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -163.02 131.19 3.79 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.392 1.077 . . . . 0.0 108.292 174.152 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 17.5 t -72.61 122.35 21.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 165.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -57.5 -27.04 62.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.186 0.994 . . . . 0.0 112.33 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.1 mt -94.84 -51.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.558 -174.925 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.0 p -128.82 11.24 6.1 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 119.455 1.025 . . . . 0.0 112.724 -172.494 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.81 41.69 28.07 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 114.68 0.632 . . . . 0.0 114.68 172.019 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -66.02 -41.83 90.46 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -177.718 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 72' ' ' PHE . 12.4 mptt 72.77 121.57 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.85 1.26 . . . . 0.0 110.771 -176.236 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -126.39 162.75 24.83 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.242 1.017 . . . . 0.0 111.378 -178.448 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -69.19 -18.73 63.95 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.413 ' HG3' ' H ' ' A' ' 86' ' ' SER . 26.0 pttm -147.32 148.63 31.58 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.44 -25.22 67.91 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.326 0.65 . . . . 0.0 110.759 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -61.29 -38.11 85.64 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.349 0.66 . . . . 0.0 110.76 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.413 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 70.8 m -68.98 -30.0 68.33 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.83 0.452 . . . . 0.0 111.1 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 93.7 t -72.39 -44.32 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 C-N-CA 123.475 0.71 . . . . 0.0 109.999 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 68.1 t -72.27 -37.86 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.295 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.08 -37.3 85.46 Favored 'General case' 0 C--N 1.35 0.601 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.615 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -71.7 -31.63 66.96 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.068 0.947 . . . . 0.0 111.245 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -71.47 -37.66 71.32 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.58 0.705 . . . . 0.0 109.103 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.62 -27.47 61.29 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.548 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -88.38 -52.36 5.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.066 0.946 . . . . 0.0 111.183 -174.722 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.9 t -97.32 -16.49 20.26 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.053 0.941 . . . . 0.0 110.983 -167.282 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -134.97 37.01 0.34 Allowed Pre-proline 0 CA--C 1.571 1.771 0 CA-C-O 118.029 -0.986 . . . . 0.0 113.038 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -66.86 -33.3 34.04 Favored 'Trans proline' 0 C--N 1.394 2.963 0 CA-C-N 121.768 1.667 . . . . 0.0 112.541 -170.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -134.38 94.8 3.27 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 CA--C 1.56 1.358 0 CA-C-O 117.735 -1.126 . . . . 0.0 109.155 179.653 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.7 p80 . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.64 0.257 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.0 mtt -85.39 88.12 7.47 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.614 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -164.75 41.9 0.08 Allowed 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.746 0.784 . . . . 0.0 108.949 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -132.38 84.28 2.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -170.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.96 118.0 31.73 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 124.989 1.315 . . . . 0.0 109.074 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . 0.57 HG22 ' H ' ' A' ' 17' ' ' GLU . 14.7 mm -125.29 156.61 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -169.249 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . 0.485 ' HB2' HD13 ' A' ' 29' ' ' LEU . 28.5 t -91.31 12.37 20.61 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.867 0.867 . . . . 0.0 110.285 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.57 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.8 mp0 88.21 -38.22 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.9 2.08 . . . . 0.0 110.705 169.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -139.17 -52.94 0.56 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.379 0.609 . . . . 0.0 109.993 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.8 p -98.52 70.5 1.96 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.218 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -148.97 -172.63 4.16 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 163.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -112.57 -104.5 0.39 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 175.163 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.76 134.05 22.99 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 161.941 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -118.26 165.33 13.96 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.572 0.749 . . . . 0.0 109.576 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -103.06 10.33 38.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.747 0.819 . . . . 0.0 111.045 177.405 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -169.01 139.74 2.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.056 0.943 . . . . 0.0 109.936 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.8 p -73.61 -37.47 65.39 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.182 0.993 . . . . 0.0 110.956 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.35 -35.13 73.37 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.526 177.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . 0.435 ' O ' HG21 ' A' ' 31' ' ' VAL . 55.6 t30 -59.12 -54.18 49.9 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.456 0.646 . . . . 0.0 109.97 170.563 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.485 HD13 ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -54.66 -30.05 54.2 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.46 1.504 . . . . 0.0 112.439 178.239 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.67 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -52.71 -24.29 8.37 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.435 HG21 ' O ' ' A' ' 28' ' ' ASN . 32.5 m -53.47 -49.12 56.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 170.929 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -74.94 -46.8 33.19 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.594 0.711 . . . . 0.0 109.273 172.533 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.67 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 19.2 ttt180 -76.82 41.87 0.29 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.615 1.566 . . . . 0.0 109.428 -173.543 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -66.79 -57.26 7.42 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.188 -163.302 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.4 tp -68.27 -26.98 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 168.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.505 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 43.1 m-70 -79.45 -34.86 41.17 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.094 1.77 . . . . 0.0 108.736 -158.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t -70.55 -36.58 73.74 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.268 -166.82 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.04 -30.71 9.84 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.734 -0.481 . . . . 0.0 112.339 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -46.38 -39.07 9.79 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.812 1.245 . . . . 0.0 114.027 170.518 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 58.39 87.37 0.14 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.549 1.14 . . . . 0.0 111.535 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.46 -179.48 4.12 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.097 1.865 . . . . 0.0 111.276 166.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.7 mt -111.92 130.72 55.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -111.93 138.03 49.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.174 0.59 . . . . 0.0 109.952 -174.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.436 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 3.5 t -63.31 116.9 5.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.05 0.94 . . . . 0.0 110.231 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.08 33.04 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.945 1.298 . . . . 0.0 112.356 -171.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.9 mm -133.66 -7.0 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 125.074 1.349 . . . . 0.0 108.679 -172.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.536 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 0.8 OUTLIER 174.05 -139.39 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 -160.593 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.536 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -143.46 135.9 6.65 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 108.22 -1.952 . . . . 0.0 108.22 172.162 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 31.5 t80 179.12 115.23 0.04 OUTLIER 'General case' 0 C--N 1.348 0.54 0 N-CA-C 102.614 -3.106 . . . . 0.0 102.614 -172.27 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.65 130.29 56.81 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 122.765 0.426 . . . . 0.0 110.255 -166.828 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . 0.632 ' SG ' ' HB2' ' A' ' 56' ' ' SER . 42.8 t -149.03 151.63 34.86 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.281 -179.245 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -80.49 -30.34 37.37 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.94 0.896 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -92.5 111.32 22.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.323 1.049 . . . . 0.0 109.12 -176.273 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -53.7 -35.22 60.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.59 1.156 . . . . 0.0 112.891 -175.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.01 -48.69 77.73 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 123.965 0.791 . . . . 0.0 111.634 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' SER . . . . . 0.632 ' HB2' ' SG ' ' A' ' 51' ' ' CYS . 46.4 m -52.07 -50.96 60.51 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -173.454 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.433 ' O ' ' HG3' ' A' ' 61' ' ' MET . 0.7 OUTLIER -72.18 -33.62 67.81 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 119.366 -0.35 . . . . 0.0 111.112 177.734 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -57.4 -38.38 74.2 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.853 0.861 . . . . 0.0 111.849 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 72.4 m95 -78.86 -27.42 44.11 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.528 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 16.3 t60 -77.25 -30.06 54.29 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.784 0.833 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.489 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 94.9 mtp -69.05 -38.69 79.26 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.849 0.46 . . . . 0.0 110.426 176.719 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -64.59 -28.48 69.66 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.175 176.036 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.528 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 28.9 mmmt -55.96 -36.54 67.93 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.544 0.338 . . . . 0.0 111.371 170.285 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.489 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 92.3 m-70 -75.0 -19.03 60.26 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.08 0.552 . . . . 0.0 111.539 176.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -91.94 -29.57 16.58 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 -172.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.25 -34.41 10.35 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.586 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.7 t70 55.21 37.4 28.85 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 123.178 1.466 . . . . 0.0 109.625 -165.377 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.8 p -62.31 -26.45 68.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.626 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -73.99 -34.82 64.33 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 123.408 0.683 . . . . 0.0 111.083 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 48.35 79.43 0.07 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.182 0.926 . . . . 0.0 110.161 -168.197 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -46.85 59.66 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.189 -175.346 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -152.13 135.95 16.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.599 -2.371 . . . . 0.0 104.599 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.4 p -157.42 119.07 3.7 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.444 0.698 . . . . 0.0 109.248 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.0 120.98 13.04 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.864 0.866 . . . . 0.0 109.417 172.067 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -57.39 -27.76 62.63 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.34 0.656 . . . . 0.0 112.077 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.1 mt -93.63 -39.35 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -172.797 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.5 p -135.1 -1.56 2.63 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.83 1.196 . . . . 0.0 113.095 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 58.27 34.19 73.2 Favored Glycine 0 C--N 1.364 2.096 0 N-CA-C 114.624 0.61 . . . . 0.0 114.624 172.016 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.436 ' HB3' ' CE1' ' A' ' 81' ' ' PHE . 9.2 tmtt? -63.92 -39.57 94.48 Favored 'General case' 0 CA--C 1.56 1.349 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -173.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . 0.423 ' HB2' ' O ' ' A' ' 79' ' ' LYS . 4.9 mptp? 80.55 119.74 0.05 Allowed 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 124.914 1.285 . . . . 0.0 110.534 -174.717 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.436 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 79.2 m-85 -133.13 149.06 52.12 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.623 1.169 . . . . 0.0 108.648 176.017 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -9.1 9.34 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -174.044 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . 0.418 ' HG3' ' H ' ' A' ' 86' ' ' SER . 24.2 pttm -151.52 147.17 26.5 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 173.013 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.42 -28.42 68.26 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.063 0.945 . . . . 0.0 110.689 176.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.69 -42.21 74.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.621 0.769 . . . . 0.0 111.462 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.418 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 75.4 m -71.11 -29.05 64.78 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.202 0.314 . . . . 0.0 111.156 176.324 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.3 t -72.55 -44.97 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.834 0.854 . . . . 0.0 110.06 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 87.3 t -72.73 -39.46 60.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 C-N-CA 124.73 1.212 . . . . 0.0 109.447 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.35 -37.33 85.1 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.609 177.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -71.92 -32.2 67.13 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.723 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -71.95 -38.75 69.74 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 109.583 -178.007 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.56 -17.77 59.95 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.024 177.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -97.65 -45.65 6.3 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.459 0.704 . . . . 0.0 111.591 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 45.2 t -100.42 -14.93 18.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.712 1.205 . . . . 0.0 111.409 -168.761 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -134.02 42.46 0.82 Allowed Pre-proline 0 CA--C 1.565 1.538 0 C-N-CA 123.826 0.85 . . . . 0.0 109.975 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.38 -29.28 62.92 Favored 'Trans proline' 0 C--N 1.387 2.597 0 C-N-CA 122.448 2.099 . . . . 0.0 113.885 -164.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.36 97.86 3.31 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 172.474 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 124.542 1.137 . . . . 0.0 109.517 176.879 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -167.81 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.066 0.946 . . . . 0.0 109.345 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -113.8 30.97 6.86 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 122.367 1.079 . . . . 0.0 108.132 177.234 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -120.75 80.99 1.7 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.423 -1.262 . . . . 0.0 107.89 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -78.84 118.38 20.82 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 113.393 -1.731 . . . . 0.0 109.501 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.2 mm -104.02 112.61 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.755 -171.249 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.5 t -59.99 101.43 0.12 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 161.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 31.48 -64.66 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 128.32 2.648 . . . . 0.0 115.592 160.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -125.04 -40.88 2.13 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.009 -166.48 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.16 -46.21 9.97 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.953 -163.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.82 127.16 31.42 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.163 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -68.74 -62.38 1.41 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.105 161.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.25 126.89 1.18 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.295 0.638 . . . . 0.0 110.833 164.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -98.71 144.72 27.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -71.88 -19.28 61.97 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -143.66 144.3 31.82 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.586 0.754 . . . . 0.0 110.055 -175.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 20.3 p -58.0 -32.98 68.44 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.853 0.861 . . . . 0.0 111.113 168.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' HIS . . . . . 0.45 ' O ' HG23 ' A' ' 31' ' ' VAL . 24.4 m-70 -68.03 -38.24 82.29 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.545 0.738 . . . . 0.0 109.994 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -49.45 75.24 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.136 0.974 . . . . 0.0 110.344 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -60.69 -36.59 79.15 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.322 178.368 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.49 -30.88 71.93 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.534 1.146 . . . . 0.0 112.284 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.45 HG23 ' O ' ' A' ' 27' ' ' HIS . 48.3 t -66.45 -45.37 89.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.146 0.578 . . . . 0.0 110.443 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -33.66 68.47 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.524 0.729 . . . . 0.0 109.903 177.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.511 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 57.6 ttt180 -63.05 -2.55 1.3 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.619 1.168 . . . . 0.0 112.226 -176.013 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.9 ptm -45.93 -11.6 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 126.241 1.817 . . . . 0.0 114.612 173.574 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -83.75 -60.96 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.581 2.159 0 C-N-CA 124.934 1.294 . . . . 0.0 109.673 168.708 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . 0.511 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.24 9.85 37.96 Favored 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -172.538 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -61.81 -56.59 17.8 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -167.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.19 -32.65 3.77 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 123.353 0.501 . . . . 0.0 112.388 -167.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -70.68 -46.56 62.96 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.706 0.802 . . . . 0.0 111.614 176.215 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt 70.7 94.96 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 125.26 1.424 . . . . 0.0 110.934 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.14 -177.4 2.3 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.512 2.141 . . . . 0.0 111.069 174.049 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -110.38 109.26 19.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.254 0.622 . . . . 0.0 109.534 -170.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.28 146.29 39.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.626 0.77 . . . . 0.0 109.248 -178.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.551 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 4.3 t -64.35 108.49 1.63 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.635 0.774 . . . . 0.0 110.177 171.83 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -67.37 4.78 0.9 Allowed 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.551 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 36.6 mm -95.23 -54.73 6.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.441 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.6 p -120.47 -110.94 0.34 Allowed 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . 0.527 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.23 164.33 28.66 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 108.798 -1.721 . . . . 0.0 108.798 156.705 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.4 t80 171.24 110.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 102.449 -3.167 . . . . 0.0 102.449 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.65 132.44 56.68 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.79 0.805 . . . . 0.0 109.446 -164.396 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.1 t -152.54 166.19 32.79 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.317 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -100.37 -6.74 25.3 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.071 0.549 . . . . 0.0 110.37 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.562 HE21 ' HB1' ' A' ' 55' ' ' ALA . 51.9 tt0 -113.21 112.3 23.53 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.396 1.078 . . . . 0.0 109.249 -175.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -51.95 -38.01 54.97 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.691 0.797 . . . . 0.0 112.537 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.562 ' HB1' HE21 ' A' ' 53' ' ' GLN . . . -59.64 -39.06 83.08 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.979 0.799 . . . . 0.0 112.364 -178.337 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -59.28 -54.98 40.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.293 0.637 . . . . 0.0 111.395 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LEU . . . . . 0.439 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.6 OUTLIER -76.58 -29.5 56.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.057 0.543 . . . . 0.0 112.183 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.82 -37.18 63.31 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.583 0.753 . . . . 0.0 112.781 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' TRP . . . . . 0.445 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 95.7 m95 -80.55 -47.34 14.34 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.281 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 72.7 t60 -45.45 -42.49 10.55 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.565 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' MET . . . . . 0.481 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 26.0 ptm -67.2 -38.74 85.85 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 118.524 0.602 . . . . 0.0 112.4 174.916 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -63.33 -30.47 71.6 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.309 0.644 . . . . 0.0 111.3 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.488 ' HG2' ' HB2' ' A' ' 70' ' ' TYR . 95.4 mttt -66.6 -28.6 68.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.258 0.623 . . . . 0.0 111.253 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' HIS . . . . . 0.481 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 76.6 m-70 -66.19 -22.59 66.35 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.395 0.678 . . . . 0.0 111.166 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.05 -56.28 12.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.924 0.49 . . . . 0.0 110.036 -174.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.76 -8.87 59.74 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.215 0.606 . . . . 0.0 112.233 171.485 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t70 72.48 -59.76 0.55 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 126.025 1.73 . . . . 0.0 113.193 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.3 t -66.8 -67.66 0.43 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.863 1.265 . . . . 0.0 113.916 -166.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -138.39 9.24 2.69 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.071 0.948 . . . . 0.0 109.949 -169.887 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' TYR . . . . . 0.488 ' HB2' ' HG2' ' A' ' 63' ' ' LYS . 40.4 t80 68.28 9.14 7.05 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 124.06 0.944 . . . . 0.0 110.53 -164.405 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -108.8 -115.69 0.29 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.803 0.841 . . . . 0.0 110.262 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -145.93 138.6 25.65 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -166.148 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.7 m -133.33 158.59 42.6 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.319 1.048 . . . . 0.0 110.281 -176.286 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.5 t -97.71 116.26 29.59 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 167.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -64.96 -19.54 66.02 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.307 0.503 . . . . 0.0 111.763 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.62 -40.03 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.233 0.613 . . . . 0.0 111.683 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -141.08 -0.88 1.42 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.54 40.65 98.08 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 114.444 0.538 . . . . 0.0 114.444 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LYS . . . . . 0.406 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 5.9 tmtt? -66.36 -28.98 69.07 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 123.401 0.68 . . . . 0.0 112.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt 71.42 110.53 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 125.316 1.446 . . . . 0.0 111.037 172.637 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' PHE . . . . . 0.406 ' CE2' ' HB3' ' A' ' 79' ' ' LYS . 97.1 m-85 -120.38 164.64 16.05 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -172.027 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -67.99 -35.55 78.53 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 114.649 -1.159 . . . . 0.0 113.027 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.87 170.54 19.57 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 117.93 0.332 . . . . 0.0 111.633 175.704 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -57.47 -40.0 77.6 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.839 1.255 . . . . 0.0 110.913 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.35 -44.47 72.19 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 123.571 0.545 . . . . 0.0 111.228 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.5 m -63.78 -34.84 78.81 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.513 0.508 . . . . 0.0 111.742 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.79 -41.49 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.424 0.69 . . . . 0.0 110.251 -175.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 89.1 t -72.42 -38.6 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.877 1.271 . . . . 0.0 109.038 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.2 96.67 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.139 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -71.9 -31.56 66.53 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.952 -178.891 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.88 -45.23 62.04 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.21 -33.19 74.09 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.013 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -92.38 -47.63 7.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.533 0.733 . . . . 0.0 111.528 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.94 -7.46 21.47 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.616 0.766 . . . . 0.0 111.918 -168.728 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -134.63 42.69 0.82 Allowed Pre-proline 0 CA--C 1.567 1.632 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.17 -32.75 10.26 Favored 'Trans proline' 0 C--N 1.391 2.768 0 CA-C-N 121.407 1.538 . . . . 0.0 110.788 177.414 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -117.39 97.17 5.75 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.251 1.154 0 C-N-CA 123.993 0.917 . . . . 0.0 108.765 174.236 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.791 0.805 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -121.09 81.24 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-N 114.7 -1.137 . . . . 0.0 108.521 -173.021 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -78.64 110.23 13.57 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.962 -174.457 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.7 mm -109.19 131.78 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.774 0.83 . . . . 0.0 109.179 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.817 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 36.2 t -90.13 52.81 2.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.394 1.077 . . . . 0.0 109.025 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 56.76 -53.12 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 126.988 2.115 . . . . 0.0 115.48 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -134.44 -45.23 0.76 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.017 1.327 . . . . 0.0 109.817 -166.692 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.5 p -107.2 37.39 2.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.529 -167.899 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -142.68 122.93 13.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.193 0.597 . . . . 0.0 109.416 160.045 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -67.13 -55.65 13.3 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.413 1.071 . . . . 0.0 109.996 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.55 130.06 0.55 Allowed 'General case' 0 C--N 1.355 0.831 0 C-N-CA 124.036 0.934 . . . . 0.0 109.621 161.642 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -110.48 154.9 23.0 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.0 5.58 45.12 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -152.14 139.92 19.91 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.311 0.645 . . . . 0.0 109.55 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.479 ' HA ' HD23 ' A' ' 29' ' ' LEU . 32.3 t -52.56 -38.9 60.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.599 1.16 . . . . 0.0 111.958 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 31' ' ' VAL . 29.6 t-80 -69.84 -39.22 76.56 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.67 0.388 . . . . 0.0 111.345 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -56.86 -47.84 79.46 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.592 0.71 . . . . 0.0 110.911 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.696 HD11 HH11 ' A' ' 33' ' ' ARG . 0.2 OUTLIER -63.99 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.582 175.376 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.42 -27.86 68.84 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.866 0.866 . . . . 0.0 112.162 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.605 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 70.9 t -61.11 -45.2 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 124.039 0.935 . . . . 0.0 110.666 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.26 -36.65 74.59 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.967 0.507 . . . . 0.0 110.438 173.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.696 HH11 HD11 ' A' ' 29' ' ' LEU . 13.4 ttt180 -68.76 6.82 0.77 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.308 1.043 . . . . 0.0 112.608 -170.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptm -45.91 -15.67 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 125.901 1.681 . . . . 0.0 114.743 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.08 -54.32 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.309 0 C-N-CA 124.941 1.297 . . . . 0.0 109.05 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -107.3 2.03 24.25 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 -173.666 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.0 t -82.29 -41.43 20.16 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 120.058 1.299 . . . . 0.0 113.81 -165.118 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.04 -31.26 8.76 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.155 0.422 . . . . 0.0 114.155 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.48 ' H ' HG23 ' A' ' 37' ' ' THR . 2.2 mp0 -84.37 -51.26 7.1 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 117.231 0.516 . . . . 0.0 110.226 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 67.17 99.8 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.693 1.597 . . . . 0.0 111.546 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.605 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 73.9 Cg_endo -69.87 -147.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.985 2.457 . . . . 0.0 111.905 170.582 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.0 mt -129.32 116.95 19.86 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.739 -0.6 . . . . 0.0 111.726 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -108.98 142.74 39.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.953 0.901 . . . . 0.0 109.334 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.482 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 13.5 t -64.49 112.18 3.02 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 124.702 1.201 . . . . 0.0 109.689 170.058 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -79.52 29.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.0 1.32 . . . . 0.0 111.77 -174.093 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.482 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 2.8 mp -119.95 -16.0 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 124.494 1.118 . . . . 0.0 108.759 -173.808 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 1.4 p -175.97 -134.29 0.01 OUTLIER 'General case' 0 C--O 1.245 0.852 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 -156.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.552 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.94 131.48 4.14 Favored Glycine 0 C--N 1.309 -0.95 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 169.76 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 39.5 t80 176.9 113.37 0.03 OUTLIER 'General case' 0 C--N 1.349 0.573 0 N-CA-C 101.954 -3.35 . . . . 0.0 101.954 -175.248 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.0 m -128.73 139.99 51.95 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -166.945 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 57' ' ' LEU . 19.3 p -153.78 166.06 34.06 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.166 -174.346 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -88.88 -31.07 18.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.264 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 138.0 38.63 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.699 0.8 . . . . 0.0 109.121 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -36.05 82.59 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -174.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.39 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -55.49 -47.91 75.42 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 -173.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 2.0 pt? -76.41 -37.44 57.07 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.487 0.585 . . . . 0.0 111.044 173.922 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.8 -44.61 66.74 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.808 0.843 . . . . 0.0 113.034 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.419 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 100.0 m95 -80.9 -36.92 30.55 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.74 -177.231 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 58.5 t60 -53.84 -33.33 55.93 Favored 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 165.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.44 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 68.2 mtm -72.82 -37.86 67.35 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.449 0.568 . . . . 0.0 110.425 174.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -59.01 -34.16 71.55 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.808 0.843 . . . . 0.0 111.281 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 33.8 mmtp -56.87 -28.78 62.22 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.641 172.893 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 39.2 m80 . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 122.67 0.388 . . . . 0.0 110.745 179.011 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -95.3 124.64 39.44 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 167.065 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -54.11 -39.29 66.26 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.296 0.569 . . . . 0.0 111.692 176.57 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 mt -86.12 -47.49 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.5 -166.098 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 20.3 p -126.99 3.42 6.53 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 119.319 0.963 . . . . 0.0 112.697 -175.251 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 52.61 37.87 51.21 Favored Glycine 0 C--N 1.361 1.972 0 N-CA-C 114.783 0.673 . . . . 0.0 114.783 174.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -30.29 71.4 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 122.83 0.452 . . . . 0.0 111.276 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt 75.11 122.34 0.04 OUTLIER 'General case' 0 C--N 1.36 1.045 0 C-N-CA 125.04 1.336 . . . . 0.0 109.587 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -130.86 162.91 28.58 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.551 0.741 . . . . 0.0 111.717 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.75 -44.46 96.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.399 1.08 . . . . 0.0 111.855 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 85' ' ' ASP . 5.5 ptmm? -140.99 156.33 46.06 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.353 0.661 . . . . 0.0 109.729 -173.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -60.85 -31.56 70.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.328 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.469 ' HB2' ' HG3' ' A' ' 83' ' ' LYS . 8.3 m-20 -56.32 -43.05 78.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.528 0.731 . . . . 0.0 111.688 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.4 m -64.54 -31.56 72.82 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.033 0.533 . . . . 0.0 111.389 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.8 t -75.66 -46.14 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.153 0.501 . . . . 0.0 110.479 -176.517 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 75.9 t -70.92 -38.04 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.15 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.88 90.76 Favored 'General case' 0 C--N 1.349 0.551 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.582 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -70.26 -37.61 74.95 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.881 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.81 -38.45 67.18 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.456 0.702 . . . . 0.0 109.787 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.83 -23.08 65.99 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.983 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -102.75 -49.29 3.85 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.6 t -88.48 -6.93 57.32 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.229 1.011 . . . . 0.0 111.607 -170.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 . . . . . 0 N--CA 1.478 0.952 0 C-N-CA 122.797 0.439 . . . . 0.0 110.2 179.164 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 122.069 0.937 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -144.64 100.21 3.48 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -172.876 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -86.64 104.48 16.1 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 20' ' ' ALA . 29.4 mm -111.12 133.12 57.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 -173.739 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.464 ' HA ' HD13 ' A' ' 29' ' ' LEU . 41.8 t -54.96 -53.0 61.28 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.853 0.861 . . . . 0.0 110.865 174.997 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 172.15 -53.75 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.972 1.309 . . . . 0.0 108.711 177.377 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -140.59 -45.69 0.41 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -175.361 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 p -88.03 64.64 7.88 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.581 -1.645 . . . . 0.0 109.703 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.443 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -157.7 134.0 9.59 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.063 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -81.16 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 166.363 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.41 124.86 1.46 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.653 0.781 . . . . 0.0 108.986 165.085 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.438 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 96.7 m-85 -102.34 150.59 23.18 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.64 0.776 . . . . 0.0 109.414 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -76.19 -17.24 59.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.847 0.459 . . . . 0.0 112.167 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -146.88 150.36 35.07 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.054 0.541 . . . . 0.0 110.701 -174.419 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 66.5 p -58.73 -34.21 71.09 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.408 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -74.02 -35.49 64.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.763 0.825 . . . . 0.0 110.955 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -60.62 -48.41 81.89 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.623 0.769 . . . . 0.0 109.906 174.734 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -66.6 -35.07 79.3 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.619 177.136 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.14 68.04 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.29 0.994 . . . . 0.0 111.88 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -56.62 -49.99 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 124.199 1.0 . . . . 0.0 111.411 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -34.9 65.99 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.398 0.618 . . . . 0.0 109.559 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 63.6 ttt180 -63.73 -7.76 8.55 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.682 -175.442 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptm -43.97 -15.19 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.25 -50.42 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.675 0 C-N-CA 124.559 1.143 . . . . 0.0 109.762 175.872 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.61 10.58 38.65 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 125.009 1.323 . . . . 0.0 112.36 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.514 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 9.0 t -55.91 -67.41 0.29 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -155.104 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLY . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' THR . . . 69.81 36.56 74.63 Favored Glycine 0 N--CA 1.473 1.147 0 CA-C-N 118.644 0.656 . . . . 0.0 112.383 -176.712 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -169.74 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.302 1.441 . . . . 0.0 108.181 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 66.53 97.92 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.166 1.386 . . . . 0.0 113.555 164.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.51 164.33 26.22 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.099 1.866 . . . . 0.0 110.046 160.645 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.93 121.32 42.88 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.574 0.75 . . . . 0.0 109.17 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -109.57 143.53 39.14 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -174.222 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 14.5 t -69.57 109.68 4.42 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.725 0.81 . . . . 0.0 109.375 176.633 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 40.63 0.96 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.779 0.832 . . . . 0.0 110.428 -178.012 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.421 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.7 mp -130.97 -12.78 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 C-N-CA 124.945 1.298 . . . . 0.0 108.356 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 4.8 p -175.57 -124.33 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 N-CA-C 102.693 -3.077 . . . . 0.0 102.693 -167.213 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.95 134.69 4.95 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 117.251 -1.86 . . . . 0.0 108.638 163.733 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.8 t80 177.57 115.95 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 102.538 -3.134 . . . . 0.0 102.538 -176.441 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 m -110.48 146.19 36.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.504 0.669 . . . . 0.0 109.724 -171.027 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 43.6 t -144.83 -170.95 3.52 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 125.675 1.59 . . . . 0.0 107.886 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 14.5 ptm180 -131.94 -19.96 2.54 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.694 0.798 . . . . 0.0 110.717 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.635 HE22 ' HB3' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -102.26 125.06 48.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.173 0.989 . . . . 0.0 108.353 -179.329 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -52.9 -56.08 18.57 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.472 1.109 . . . . 0.0 113.266 -172.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ALA . . . . . 0.635 ' HB3' HE22 ' A' ' 53' ' ' GLN . . . -53.71 -39.66 65.4 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.048 0.539 . . . . 0.0 112.193 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.565 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 23.5 t -54.75 -55.74 26.71 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.0 pt? -74.07 -26.31 60.32 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.042 0.383 . . . . 0.0 110.866 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' MET . 6.0 t30 -62.88 -25.11 68.14 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.609 0.764 . . . . 0.0 112.126 169.747 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.2 m95 -82.62 -39.1 22.63 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.62 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 63.1 t60 -58.33 -31.12 67.25 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 169.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 26.2 ptm -71.7 -31.44 66.75 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 119.496 1.044 . . . . 0.0 110.329 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -61.29 -32.67 72.52 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.126 0.571 . . . . 0.0 111.311 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 27.5 mmmt -62.66 -35.86 81.0 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.832 170.584 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 38.4 m80 . . . . . 0 N--CA 1.494 1.729 0 C-N-CA 123.244 0.617 . . . . 0.0 111.584 170.161 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.596 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 13.3 p . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.469 0.652 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.8 t -109.55 115.35 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.944 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -67.75 -14.64 63.12 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.492 HD11 ' HE3' ' A' ' 91' ' ' LYS . 2.6 mt -90.06 -38.6 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.423 0.689 . . . . 0.0 112.078 -174.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -137.76 -1.72 2.0 Allowed 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.59 38.78 93.58 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 113.895 0.318 . . . . 0.0 113.895 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -40.47 92.07 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 122.923 0.489 . . . . 0.0 111.672 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 14.0 mptt 72.54 116.81 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.947 1.299 . . . . 0.0 111.034 -177.327 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -125.1 163.67 21.89 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.854 0.862 . . . . 0.0 111.176 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -73.66 -44.85 55.67 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.741 0.816 . . . . 0.0 112.419 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -145.7 163.4 35.02 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.727 0.411 . . . . 0.0 111.793 -167.635 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -49.67 -39.35 36.21 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 125.488 1.515 . . . . 0.0 112.062 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.91 -46.25 67.93 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.458 1.099 . . . . 0.0 111.154 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -71.98 -35.75 69.6 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.517 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -75.28 -51.04 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 123.963 0.905 . . . . 0.0 111.345 -170.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.01 -34.38 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.257 -172.396 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.92 88.57 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.304 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.18 -33.7 67.88 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.998 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.492 ' HE3' HD11 ' A' ' 76' ' ' ILE . 87.2 tttt -73.12 -44.36 60.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.322 0.582 . . . . 0.0 110.171 -178.622 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.76 -22.54 67.01 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.768 -1.105 . . . . 0.0 112.174 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -106.35 -50.19 3.2 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.1 t -90.66 -9.3 47.38 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.52 0.728 . . . . 0.0 111.49 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.8 m-70 . . . . . 0 N--CA 1.484 1.266 0 C-N-CA 123.295 0.638 . . . . 0.0 110.634 178.881 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -129.25 83.27 2.13 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -170.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -97.8 120.89 39.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.573 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.686 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -118.42 157.87 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.067 0.947 . . . . 0.0 109.147 -164.825 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.688 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.9 t -96.74 -12.37 23.82 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.186 0.594 . . . . 0.0 110.744 176.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.686 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.5 tt0 97.59 -20.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 126.513 1.925 . . . . 0.0 111.065 167.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -135.9 -51.5 0.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.871 0.843 . . . . 0.0 109.138 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.9 p -121.17 72.67 1.0 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.464 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.688 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.03 145.74 4.32 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.966 0.889 . . . . 0.0 112.694 163.09 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.13 -168.23 1.05 Allowed 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 113.318 -1.764 . . . . 0.0 109.377 162.577 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.75 125.44 30.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.19 0.596 . . . . 0.0 109.823 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.588 ' HE1' ' HB1' ' A' ' 20' ' ' ALA . 77.1 m-85 -111.53 148.88 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.742 0.817 . . . . 0.0 109.044 174.634 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -61.98 -30.17 70.76 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.091 0.556 . . . . 0.0 111.669 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 53.1 m -144.85 151.06 38.18 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.32 0.648 . . . . 0.0 110.83 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.534 ' HA ' HD23 ' A' ' 29' ' ' LEU . 34.4 t -57.55 -37.11 72.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.871 0.868 . . . . 0.0 111.462 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 -69.54 -35.25 75.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.028 0.931 . . . . 0.0 111.98 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.92 -45.88 91.77 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.462 0.648 . . . . 0.0 110.643 174.681 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -68.36 -29.54 68.28 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.676 174.274 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.75 -26.31 68.63 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.349 0.66 . . . . 0.0 111.568 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 64.1 t -61.84 -47.64 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 122.845 0.458 . . . . 0.0 110.241 171.426 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -62.32 -38.4 89.29 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.732 0.813 . . . . 0.0 110.407 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -65.29 2.37 0.86 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.733 1.213 . . . . 0.0 112.214 -175.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.1 ptp -44.81 -19.48 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 125.209 1.404 . . . . 0.0 113.425 171.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.9 tp -86.52 -51.02 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 125.538 1.535 . . . . 0.0 110.572 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.87 5.33 40.93 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 123.451 0.7 . . . . 0.0 112.235 -173.465 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.7 t -59.32 -57.33 13.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -164.084 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.67 -31.66 2.18 Favored Glycine 0 CA--C 1.538 1.53 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 -169.191 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.43 -45.82 57.87 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 109.91 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt 66.42 98.3 0.04 OUTLIER Pre-proline 0 C--N 1.357 0.932 0 O-C-N 124.918 1.386 . . . . 0.0 111.072 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -70.68 -170.89 0.49 Allowed 'Trans proline' 0 C--N 1.382 2.339 0 C-N-CA 122.899 2.399 . . . . 0.0 111.391 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 54' ' ' LYS . 39.8 mt -99.02 119.37 37.67 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -172.013 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 49' ' ' PHE . 50.7 tt0 -135.45 144.38 46.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 122.716 0.407 . . . . 0.0 111.542 -171.841 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 6.6 t -64.93 107.7 1.56 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.174 0.989 . . . . 0.0 110.684 174.665 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.62 14.58 1.25 Allowed 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.175 0.99 . . . . 0.0 112.551 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.45 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 32.3 mm -96.53 -53.66 7.88 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.607 ' HG ' ' H ' ' A' ' 48' ' ' GLY . 20.1 p -119.65 -107.15 0.37 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.772 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.607 ' H ' ' HG ' ' A' ' 47' ' ' CYS . . . -149.5 166.82 29.68 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 156.05 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.414 ' H ' ' HG3' ' A' ' 43' ' ' GLN . 74.5 t80 168.45 111.26 0.01 OUTLIER 'General case' 0 C--N 1.346 0.452 0 N-CA-C 102.185 -3.265 . . . . 0.0 102.185 175.789 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -115.05 132.93 56.44 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.559 0.695 . . . . 0.0 109.214 -169.851 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.6 t -149.43 175.28 11.61 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.971 -1.468 . . . . 0.0 109.024 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.6 ppt_? -103.41 3.25 34.88 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.907 0.883 . . . . 0.0 110.891 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -127.9 103.74 7.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.046 0.938 . . . . 0.0 108.645 -174.281 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.486 ' HB3' HD13 ' A' ' 42' ' ' LEU . 21.0 ptmt -58.6 -28.83 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.568 0.747 . . . . 0.0 112.57 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.19 -39.79 70.01 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.926 0.89 . . . . 0.0 111.829 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.4 t -63.22 -54.64 34.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.768 0.827 . . . . 0.0 111.172 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.538 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -74.29 -27.67 60.83 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.98 0.512 . . . . 0.0 112.224 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.457 ' O ' ' HG2' ' A' ' 61' ' ' MET . 44.3 t30 -51.48 -51.66 53.16 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.603 0.761 . . . . 0.0 112.17 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -81.75 -32.41 31.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.564 0.221 . . . . 0.0 111.028 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.538 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 76.0 t60 -48.97 -42.43 37.65 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 163.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.457 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 17.2 ptm -70.99 -31.87 68.53 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 119.617 1.099 . . . . 0.0 111.604 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.253 0.621 . . . . 0.0 111.351 170.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -63.12 -36.51 83.84 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.624 0.369 . . . . 0.0 110.58 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 43.2 m80 . . . . . 0 N--CA 1.485 1.315 0 C-N-CA 123.556 0.742 . . . . 0.0 109.86 178.102 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 C--O 1.233 0.23 0 CA-C-O 121.366 0.603 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 12.1 t -90.14 125.04 35.31 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 172.337 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -52.87 -30.68 35.26 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.815 0.846 . . . . 0.0 113.153 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -103.79 -30.92 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -163.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 18.8 p -136.85 -0.31 2.33 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.863 0.756 . . . . 0.0 112.099 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 59.56 34.35 81.04 Favored Glycine 0 C--N 1.358 1.779 0 N-CA-C 114.301 0.48 . . . . 0.0 114.301 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 7.6 tmtt? -63.37 -30.62 71.72 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.462 1.105 . . . . 0.0 112.442 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm 74.13 116.69 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.742 1.217 . . . . 0.0 111.28 175.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.411 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 94.9 m-85 -131.32 159.37 38.08 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.693 0.797 . . . . 0.0 110.269 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.34 -31.18 67.07 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.422 0.689 . . . . 0.0 111.729 -177.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 86' ' ' SER . 18.2 ptpt -134.04 148.06 51.02 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.55 -35.56 68.27 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.916 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.98 -45.96 71.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.149 0.979 . . . . 0.0 111.132 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.426 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 19.9 t -69.32 -28.36 66.18 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.043 0.537 . . . . 0.0 110.839 -176.919 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 87.0 t -70.57 -46.77 68.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.019 0.928 . . . . 0.0 109.967 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.1 t -71.93 -36.22 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.819 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.36 79.48 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.622 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -70.9 -34.55 71.68 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.529 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -38.53 71.1 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.089 0.956 . . . . 0.0 109.351 -174.438 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.51 -18.13 63.65 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.778 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -96.51 -49.78 5.0 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.422 0.689 . . . . 0.0 110.792 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.0 t -82.79 -32.31 27.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.255 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 5.1 m80 . . . . . 0 CA--C 1.573 1.85 0 C-N-CA 122.761 0.424 . . . . 0.0 111.505 -171.702 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.402 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 3.2 p-10 -172.95 103.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.676 -172.507 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -84.76 124.85 32.01 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.334 0.654 . . . . 0.0 110.74 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.588 HG22 ' H ' ' A' ' 17' ' ' GLU . 5.3 mm -115.03 150.77 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 -172.633 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.691 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 t -83.97 -19.1 35.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.2 0.6 . . . . 0.0 109.492 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 15' ' ' ILE . 32.4 tt0 77.06 0.37 3.05 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.787 1.635 . . . . 0.0 110.701 173.635 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -136.16 -50.48 0.69 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.107 0.963 . . . . 0.0 108.612 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.36 77.05 1.53 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.56 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.691 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.52 137.37 2.26 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.942 0.897 . . . . 0.0 110.948 167.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.429 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 ptt180 -70.3 -77.95 0.08 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.337 168.485 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.429 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -163.44 149.42 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.449 0.7 . . . . 0.0 110.233 171.087 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -126.83 152.63 46.73 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.379 0.671 . . . . 0.0 110.258 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -61.76 -32.62 72.89 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.63 0.772 . . . . 0.0 112.357 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -147.63 160.04 43.1 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.887 0.375 . . . . 0.0 111.118 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 p -56.68 -35.67 68.73 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.259 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -75.9 -35.55 59.77 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.0 0.92 . . . . 0.0 112.501 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -50.41 69.88 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.158 0.98 . . . . 0.0 109.041 169.602 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -60.02 -40.2 88.46 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 113.767 -1.56 . . . . 0.0 112.523 172.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.615 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -56.47 -26.9 55.54 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.617 0.767 . . . . 0.0 112.571 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.451 HG13 HG21 ' A' ' 50' ' ' THR . 85.5 t -60.35 -44.96 97.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 123.862 0.865 . . . . 0.0 110.681 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -72.15 -45.98 58.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.523 0.729 . . . . 0.0 110.769 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.615 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 29.8 ttt180 -63.39 -5.13 3.23 Favored 'General case' 0 C--O 1.212 -0.92 0 C-N-CA 125.779 1.632 . . . . 0.0 111.467 -174.844 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.5 ptm -47.44 -12.91 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 125.338 1.455 . . . . 0.0 114.69 173.923 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -83.99 -52.57 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.579 0 C-N-CA 124.715 1.206 . . . . 0.0 109.431 173.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -104.7 1.41 29.35 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.7 t -70.74 -49.61 45.04 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -165.003 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.94 -30.55 3.55 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-O 120.01 -0.328 . . . . 0.0 112.403 -164.526 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -103.8 76.87 1.41 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 124.713 1.205 . . . . 0.0 108.444 175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -52.79 131.56 47.59 Favored Pre-proline 0 CA--C 1.558 1.272 0 C-N-CA 123.333 0.653 . . . . 0.0 111.969 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.85 -172.87 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.568 2.179 . . . . 0.0 111.238 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.4 mt -103.06 99.36 9.24 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.51 134.15 55.31 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -166.751 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.431 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 23.2 t -74.66 106.65 6.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.896 0.878 . . . . 0.0 110.189 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.11 42.26 1.02 Allowed 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.164 0.983 . . . . 0.0 110.493 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.431 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.3 mp -127.78 -2.28 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.563 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 6.6 p 173.71 -136.79 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 -168.547 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.503 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -144.39 127.07 2.84 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.889 -2.084 . . . . 0.0 107.889 171.184 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.9 t80 179.7 112.02 0.04 OUTLIER 'General case' 0 C--O 1.237 0.434 0 N-CA-C 102.147 -3.279 . . . . 0.0 102.147 -167.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.451 HG21 HG13 ' A' ' 31' ' ' VAL . 2.9 m -123.56 144.96 49.24 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.612 0.72 . . . . 0.0 109.804 -170.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 81.6 m -147.26 171.16 15.84 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.696 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.491 ' HD2' ' H ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -117.42 -7.2 11.18 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.887 170.198 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -102.83 111.77 24.26 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 169.128 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -58.32 -33.88 69.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.604 0.761 . . . . 0.0 111.277 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.64 -42.82 71.72 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 124.456 1.098 . . . . 0.0 112.413 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -55.27 -53.78 51.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.967 0.907 . . . . 0.0 112.442 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.1 pt? -75.86 -27.39 57.78 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.066 0.547 . . . . 0.0 111.567 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 61' ' ' MET . 67.0 t30 -55.1 -44.76 75.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.783 0.833 . . . . 0.0 113.208 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.491 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 66.0 p-90 -82.52 -39.79 21.9 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 122.03 -0.419 . . . . 0.0 110.345 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 75.9 t60 -48.06 -35.25 10.9 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 171.8 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 23.7 ptp -70.03 -37.56 75.65 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 119.174 0.897 . . . . 0.0 111.043 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 19.4 ttmm -56.93 -37.11 71.04 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.872 0.869 . . . . 0.0 110.699 172.117 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -61.3 -31.39 71.23 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.654 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 37.3 m80 . . . . . 0 N--CA 1.49 1.545 0 C-N-CA 123.302 0.641 . . . . 0.0 111.706 176.508 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 89.3 p . . . . . 0 C--O 1.24 0.566 0 CA-C-O 121.801 0.81 . . . . 0.0 111.133 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.66 117.4 30.04 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -67.41 -9.39 41.22 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.337 0.517 . . . . 0.0 112.299 -174.462 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 91' ' ' LYS . 3.2 mt -96.69 -37.39 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.199 0.6 . . . . 0.0 111.905 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.9 p -139.64 8.79 2.39 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 54.0 42.8 71.69 Favored Glycine 0 C--N 1.344 1.019 0 C-N-CA 123.884 0.755 . . . . 0.0 114.885 173.3 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -66.52 -39.34 88.6 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 11.6 mptt 71.23 117.75 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 124.417 1.087 . . . . 0.0 109.853 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 87.6 m-85 -124.39 170.63 10.64 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.73 0.812 . . . . 0.0 110.148 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HG2' ' A' ' 83' ' ' LYS . 13.7 pt-20 -64.29 -41.34 96.93 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.369 173.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HG2' ' HG3' ' A' ' 82' ' ' GLU . 17.3 ptpt -142.27 157.64 44.6 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.318 0.647 . . . . 0.0 109.554 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -67.7 -21.99 65.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.64 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -60.13 -43.98 95.27 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.495 0.318 . . . . 0.0 110.76 171.565 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.2 m -66.07 -29.28 69.59 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.178 0.591 . . . . 0.0 111.449 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 65.3 t -71.37 -49.18 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.013 0.925 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 96.0 t -74.34 -33.01 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.838 1.255 . . . . 0.0 109.92 -174.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.85 89.02 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.802 173.671 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -73.96 -35.35 64.51 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.272 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 76' ' ' ILE . 85.0 tttt -70.88 -46.7 62.14 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.44 1.096 . . . . 0.0 111.213 -169.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -20.75 66.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.684 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.2 mmtm -99.03 -47.62 5.17 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.117 0.567 . . . . 0.0 111.006 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.2 t -84.84 -20.25 31.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.018 0.927 . . . . 0.0 111.761 -170.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 122.975 0.51 . . . . 0.0 110.258 -176.244 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.73 101.92 3.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -99.48 115.03 28.35 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.465 HG23 ' HB3' ' A' ' 20' ' ' ALA . 31.6 mm -119.36 134.18 63.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -170.553 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.8 t -57.69 -51.43 69.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.264 1.025 . . . . 0.0 110.711 172.895 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 166.14 -54.08 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 125.758 1.623 . . . . 0.0 109.367 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -137.46 -51.3 0.63 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.308 -169.083 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -90.78 61.39 4.74 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.112 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.465 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -153.94 128.64 9.38 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.02 169.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -69.79 -79.45 0.06 Allowed 'General case' 0 CA--C 1.55 0.942 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 169.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.72 140.63 5.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.204 1.002 . . . . 0.0 108.613 163.473 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.25 145.12 43.39 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.678 0.791 . . . . 0.0 109.044 175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -78.78 -9.36 59.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.857 0.463 . . . . 0.0 112.035 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -147.06 147.13 30.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.299 0.64 . . . . 0.0 110.77 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.435 ' HA ' HD23 ' A' ' 29' ' ' LEU . 22.6 t -62.09 -34.34 76.12 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.01 0.924 . . . . 0.0 111.844 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -73.25 -33.89 65.54 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 120.803 0.335 . . . . 0.0 110.36 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.79 -42.9 94.42 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.555 0.742 . . . . 0.0 111.127 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.3 OUTLIER -66.0 -34.46 78.14 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.969 175.105 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.18 -27.8 68.67 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 112.324 176.48 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.486 HG13 HG21 ' A' ' 50' ' ' THR . 79.1 t -63.02 -48.88 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.245 0.618 . . . . 0.0 110.976 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -62.56 -35.09 78.37 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.673 0.789 . . . . 0.0 109.943 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -66.22 4.34 0.72 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.975 1.31 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -46.79 -15.21 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 125.519 1.528 . . . . 0.0 114.622 170.524 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -49.88 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.638 0 C-N-CA 125.346 1.458 . . . . 0.0 110.212 173.812 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.0 -10.43 20.55 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -169.862 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.4 t -72.68 -42.05 64.68 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -161.536 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.12 -29.85 3.06 Favored Glycine 0 CA--C 1.541 1.693 0 CA-C-O 120.401 -0.11 . . . . 0.0 112.986 -165.78 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -107.79 77.78 1.15 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 125.174 1.389 . . . . 0.0 108.027 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -49.14 133.1 16.07 Favored Pre-proline 0 N--CA 1.491 1.58 0 C-N-CA 123.925 0.89 . . . . 0.0 112.06 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -70.88 -178.63 2.87 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.709 2.273 . . . . 0.0 111.516 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.403 ' N ' HD12 ' A' ' 42' ' ' LEU . 3.8 mp -102.03 90.04 3.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -170.373 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -121.65 142.92 49.66 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.532 0.733 . . . . 0.0 110.177 -172.445 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 40.8 t -69.85 108.1 3.83 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.527 1.131 . . . . 0.0 109.746 174.344 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.55 48.41 1.3 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 122.84 1.305 . . . . 0.0 108.492 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.523 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -126.53 -9.92 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 125.748 1.619 . . . . 0.0 108.049 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 5.8 p 179.61 -123.5 0.0 OUTLIER 'General case' 0 C--N 1.348 0.543 0 N-CA-C 102.758 -3.053 . . . . 0.0 102.758 -162.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.572 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.82 143.81 11.23 Favored Glycine 0 C--N 1.308 -1.001 0 CA-C-O 117.342 -1.81 . . . . 0.0 108.978 159.326 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.4 t80 177.38 112.36 0.03 OUTLIER 'General case' 0 C--N 1.361 1.093 0 N-CA-C 103.052 -2.944 . . . . 0.0 103.052 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.486 HG21 HG13 ' A' ' 31' ' ' VAL . 2.7 m -119.19 148.19 43.38 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 118.712 0.687 . . . . 0.0 109.733 -171.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 87.8 m -152.21 169.06 23.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.509 1.124 . . . . 0.0 110.256 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.1 ttt180 -84.41 -36.42 22.42 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.503 0.721 . . . . 0.0 110.002 170.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -92.67 130.13 38.39 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.462 0.705 . . . . 0.0 109.306 -173.873 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -61.63 -41.44 97.49 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.659 0.784 . . . . 0.0 110.399 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -43.18 65.9 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.72 0.808 . . . . 0.0 112.276 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.0 m -51.94 -53.41 41.44 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.705 0.802 . . . . 0.0 112.434 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.58 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.3 pt? -77.14 -28.55 54.3 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.745 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -61.75 -30.91 71.09 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 118.495 0.588 . . . . 0.0 112.18 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -79.82 -49.47 11.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -49.29 -36.82 21.91 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.4 ' SD ' ' N ' ' A' ' 62' ' ' LYS . 3.6 ppp? -71.02 -35.44 72.02 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.509 1.05 . . . . 0.0 110.309 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.4 ' N ' ' SD ' ' A' ' 61' ' ' MET . 30.1 ttmt -67.06 -28.33 68.11 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.54 0.736 . . . . 0.0 111.462 172.001 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -61.98 -32.23 72.65 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.091 0.556 . . . . 0.0 112.021 170.182 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 42.0 m80 . . . . . 0 N--CA 1.496 1.859 0 C-N-CA 122.699 0.4 . . . . 0.0 111.558 170.562 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 73.0 p . . . . . 0 C--O 1.239 0.513 0 CA-C-O 120.912 0.387 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.575 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 43.9 t -95.77 116.24 28.6 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -60.96 -15.72 34.65 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 122.062 -0.399 . . . . 0.0 111.578 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 mt -97.2 -37.6 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.23 0.612 . . . . 0.0 109.818 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 77' ' ' CYS . 14.1 p -160.05 56.85 0.36 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 121.019 0.438 . . . . 0.0 110.893 -178.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.575 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -25.48 74.26 0.0 OUTLIER Glycine 0 N--CA 1.492 2.392 0 C-N-CA 127.205 2.336 . . . . 0.0 118.265 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -88.46 -8.76 54.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.061 0.944 . . . . 0.0 111.682 171.378 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? 68.83 107.15 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.564 1.146 . . . . 0.0 110.298 173.691 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -110.59 168.05 9.76 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.044 0.538 . . . . 0.0 111.643 -172.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -59.66 -28.41 67.23 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.071 0.948 . . . . 0.0 112.297 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -163.66 161.72 23.79 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.351 0.661 . . . . 0.0 110.302 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 88' ' ' VAL . 25.0 pttm -65.8 -27.71 68.47 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.175 177.235 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -58.87 -39.68 82.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.575 0.75 . . . . 0.0 111.354 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.4 m -67.39 -31.72 72.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.234 0.613 . . . . 0.0 111.046 174.775 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.03 -40.91 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.732 0.813 . . . . 0.0 110.347 -177.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 84' ' ' LYS . 58.4 t -73.13 -36.16 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.293 1.037 . . . . 0.0 109.225 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 93' ' ' LYS . . . -65.63 -40.68 92.81 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.418 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -71.82 -33.93 68.91 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.633 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -70.37 -33.5 71.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.136 0.974 . . . . 0.0 108.77 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.79 74.33 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.18 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 93' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 29.2 mmtp -93.95 -48.49 6.23 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.962 0.41 . . . . 0.0 111.092 -172.13 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -90.34 -23.74 21.04 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.68 0.792 . . . . 0.0 111.239 -171.069 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 . . . . . 0 CA--C 1.572 1.796 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.447 -173.779 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.86 90.04 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.484 1.113 . . . . 0.0 111.692 172.336 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -77.91 121.77 24.6 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.599 -176.793 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.419 HG22 ' H ' ' A' ' 17' ' ' GLU . 20.6 mm -112.81 117.18 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.139 -171.017 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.6 t -57.7 -23.65 52.78 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.527 1.131 . . . . 0.0 111.572 172.933 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.419 ' H ' HG22 ' A' ' 15' ' ' ILE . 42.3 tt0 115.93 -24.84 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.53 0 C-N-CA 127.287 2.235 . . . . 0.0 111.18 164.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -133.81 -48.65 0.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.809 0.814 . . . . 0.0 109.091 -177.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.1 p -114.92 64.02 0.68 Allowed 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.209 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -162.98 112.86 1.38 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.176 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -68.29 -45.17 73.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 169.573 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.58 148.97 2.03 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 123.772 0.829 . . . . 0.0 110.971 157.929 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -118.1 148.04 42.69 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -65.65 -25.54 67.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.4 m -147.02 156.93 43.42 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.964 0.411 . . . . 0.0 111.827 -175.203 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.3 p -59.11 -37.24 76.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.537 170.277 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.402 ' O ' HG23 ' A' ' 31' ' ' VAL . 15.2 m-70 -69.37 -39.26 78.14 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.867 0.867 . . . . 0.0 109.95 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -60.21 -51.06 71.19 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.52 1.128 . . . . 0.0 110.623 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -33.54 75.94 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.86 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.96 69.91 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.962 0.905 . . . . 0.0 112.207 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.566 HG21 ' HE ' ' A' ' 52' ' ' ARG . 25.8 t -68.32 -40.21 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.433 0.458 . . . . 0.0 110.338 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.82 -39.27 69.92 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.542 0.737 . . . . 0.0 109.69 175.717 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -64.08 -6.47 6.48 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.22 1.408 . . . . 0.0 111.614 -176.359 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.505 ' SD ' ' HB ' ' A' ' 50' ' ' THR . 25.9 ptt? -46.94 -15.19 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -54.4 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 125.226 1.41 . . . . 0.0 109.406 176.677 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.96 5.12 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 123.799 0.84 . . . . 0.0 112.98 -175.046 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -62.39 -35.78 80.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.747 0.419 . . . . 0.0 112.085 -168.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.57 -25.24 3.96 Favored Glycine 0 C--N 1.35 1.33 0 O-C-N 123.019 0.199 . . . . 0.0 112.719 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -128.47 89.22 2.86 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -53.56 112.73 3.97 Favored Pre-proline 0 N--CA 1.49 1.554 0 C-N-CA 123.946 0.898 . . . . 0.0 110.651 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.02 -67.35 0.04 OUTLIER 'Trans proline' 0 C--N 1.385 2.459 0 C-N-CA 122.682 2.255 . . . . 0.0 112.124 -173.43 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.5 ' HB3' HD21 ' A' ' 57' ' ' LEU . 85.4 mt -145.67 96.52 2.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.395 1.078 . . . . 0.0 108.458 -176.866 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -132.52 143.06 49.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.372 0.669 . . . . 0.0 110.545 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.4 t -63.91 110.53 2.13 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.335 1.054 . . . . 0.0 110.311 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -84.92 29.73 0.62 Allowed 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 123.845 0.858 . . . . 0.0 111.487 -178.224 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.35 -56.49 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.497 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.7 p -113.71 -117.67 0.32 Allowed 'General case' 0 C--O 1.239 0.507 0 N-CA-C 102.447 -3.168 . . . . 0.0 102.447 166.912 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.497 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.96 163.74 28.29 Favored Glycine 0 C--N 1.313 -0.696 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 156.32 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.6 t80 172.33 112.55 0.01 OUTLIER 'General case' 0 C--O 1.24 0.566 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.505 ' HB ' ' SD ' ' A' ' 34' ' ' MET . 3.4 m -114.3 138.05 51.01 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -173.076 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -144.97 162.06 37.84 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.761 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.566 ' HE ' HG21 ' A' ' 31' ' ' VAL . 38.0 ttm180 -76.98 -31.61 56.65 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.575 175.828 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -106.71 122.16 45.8 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.701 0.8 . . . . 0.0 109.685 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -49.43 -47.59 47.98 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.63 1.172 . . . . 0.0 111.974 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.44 -31.85 47.21 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -63.43 -56.04 19.4 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.676 0.39 . . . . 0.0 111.371 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -75.06 -30.72 61.07 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.958 0.503 . . . . 0.0 111.646 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.02 -48.58 64.43 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.606 1.162 . . . . 0.0 112.776 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.439 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 8.8 m95 -77.06 -42.41 38.47 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 59.6 t60 -46.42 -41.36 13.63 Favored 'General case' 0 CA--C 1.569 1.678 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 168.708 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 75.0 mtm -71.41 -43.15 67.31 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 118.217 0.462 . . . . 0.0 111.562 177.339 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -60.31 -25.36 65.72 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 123.025 0.53 . . . . 0.0 111.855 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 32.6 mmmt -62.4 -38.59 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.924 0.49 . . . . 0.0 110.559 171.956 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 53.5 m80 . . . . . 0 N--CA 1.496 1.856 0 C-N-CA 123.051 0.54 . . . . 0.0 111.085 172.154 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.233 0.219 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.617 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 0.9 OUTLIER -72.16 135.56 46.2 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 167.062 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.5 -27.07 65.82 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.975 0.91 . . . . 0.0 113.409 -174.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -113.08 -38.55 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 122.919 0.487 . . . . 0.0 110.308 -170.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.9 p -150.37 64.37 0.95 Allowed 'General case' 0 C--N 1.353 0.759 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -177.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.617 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -35.98 77.86 0.0 OUTLIER Glycine 0 C--N 1.355 1.627 0 C-N-CA 125.13 1.347 . . . . 0.0 116.407 167.815 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -68.41 -28.75 67.36 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.127 0.971 . . . . 0.0 110.989 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? 74.52 111.37 0.07 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 124.924 1.29 . . . . 0.0 110.387 -174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -116.6 155.82 28.06 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.17 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -29.97 66.29 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -135.4 150.96 50.02 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 122.82 0.448 . . . . 0.0 109.859 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -60.73 -30.4 69.96 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.977 0.911 . . . . 0.0 111.052 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -53.16 -45.8 68.63 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.828 0.705 . . . . 0.0 110.874 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.0 m -68.03 -30.46 69.7 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 t -74.56 -46.42 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.203 0.601 . . . . 0.0 110.024 -176.46 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -73.32 -37.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.664 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.65 -40.73 92.8 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 124.221 0.951 . . . . 0.0 109.354 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.99 -37.72 78.9 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.322 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -70.8 -41.19 71.94 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.804 0.841 . . . . 0.0 109.835 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.98 -28.72 68.49 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.273 0.629 . . . . 0.0 111.301 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -82.13 -53.53 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.539 1.136 . . . . 0.0 110.965 -174.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.03 -15.57 16.73 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.213 -166.524 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 . . . . . 0 CA--C 1.57 1.747 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -173.213 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.525 HH11 ' HA ' ' A' ' 24' ' ' LYS . 34.4 ttp85 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -141.13 97.38 3.16 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -169.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 81.7 m-85 -91.55 108.03 19.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.164 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.1 mm -109.15 149.74 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 25.4 t -94.01 -23.86 17.86 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 0.0 110.505 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 113.97 -27.18 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 128.533 2.733 . . . . 0.0 111.024 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -135.88 -51.66 0.73 Allowed 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.652 0.739 . . . . 0.0 109.927 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 p -113.34 57.27 0.68 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.833 -172.481 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.628 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -159.91 116.12 2.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.962 0.905 . . . . 0.0 109.578 165.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -68.34 -48.92 63.55 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.07 164.28 9.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.368 1.067 . . . . 0.0 109.627 160.62 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.483 ' HB2' ' HB2' ' A' ' 14' ' ' TYR . 88.5 m-85 -131.27 143.54 50.63 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.516 0.726 . . . . 0.0 109.815 167.731 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.525 ' HA ' HH11 ' A' ' 12' ' ' ARG . 25.9 ttpp -74.81 -24.83 58.69 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.071 0.948 . . . . 0.0 110.791 173.032 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -139.85 140.2 36.49 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.692 0.797 . . . . 0.0 110.336 -171.415 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.8 t -67.78 -25.88 65.83 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.234 172.687 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 26.4 m80 -70.44 -38.19 74.47 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.816 0.446 . . . . 0.0 110.799 174.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.66 -44.79 85.24 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 122.136 0.97 . . . . 0.0 109.617 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.64 -37.35 81.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.661 -1.609 . . . . 0.0 110.999 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.68 74.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.644 0.777 . . . . 0.0 112.23 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.689 HG13 ' HB ' ' A' ' 50' ' ' THR . 87.3 t -62.94 -44.74 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.649 0.78 . . . . 0.0 110.468 176.513 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -69.27 -38.02 78.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.84 0.856 . . . . 0.0 110.732 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.498 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 37.3 ttp180 -70.04 0.74 5.51 Favored 'General case' 0 C--O 1.21 -0.986 0 C-N-CA 124.319 1.047 . . . . 0.0 111.743 -172.471 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -46.43 -17.56 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 124.895 1.278 . . . . 0.0 114.319 172.526 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -54.17 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 124.427 1.091 . . . . 0.0 109.449 174.041 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -96.39 7.98 45.15 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.887 0.875 . . . . 0.0 111.658 -170.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 3.6 t -56.3 -64.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -156.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.6 35.69 75.02 Favored Glycine 0 N--CA 1.474 1.188 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.409 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 38.4 mt-10 -146.1 -38.01 0.24 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.567 1.547 . . . . 0.0 108.122 -169.46 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt 72.16 78.21 0.2 Allowed Pre-proline 0 C--N 1.358 0.95 0 C-N-CA 125.483 1.513 . . . . 0.0 109.9 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.43 170.01 19.09 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 122.82 2.347 . . . . 0.0 111.384 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.7 mt -111.48 140.62 45.92 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.674 0.79 . . . . 0.0 109.757 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 143.66 50.99 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -173.454 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.0 t -63.56 106.52 0.96 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.43 -29.18 33.98 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.909 1.283 . . . . 0.0 112.027 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.6 mm -74.29 -47.9 38.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 123.17 0.588 . . . . 0.0 109.985 -176.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.0 p -142.96 -89.36 0.13 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 120.586 0.231 . . . . 0.0 111.109 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.602 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -156.23 132.81 3.44 Favored Glycine 0 C--N 1.339 0.75 0 CA-C-O 116.838 -2.09 . . . . 0.0 109.709 -170.769 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.1 t80 168.1 112.91 0.01 OUTLIER 'General case' 0 C--N 1.353 0.752 0 N-CA-C 103.065 -2.939 . . . . 0.0 103.065 170.652 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.689 ' HB ' HG13 ' A' ' 31' ' ' VAL . 2.9 m -113.63 134.98 54.41 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -175.368 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 4.8 p -159.62 159.16 32.82 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 124.089 0.868 . . . . 0.0 110.891 176.582 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.46 -10.68 59.44 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.319 1.048 . . . . 0.0 111.252 176.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -103.01 109.31 20.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.392 1.077 . . . . 0.0 108.994 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -52.06 -42.47 63.17 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.467 0.707 . . . . 0.0 111.712 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.89 -41.73 64.63 Favored 'General case' 0 CA--C 1.556 1.186 0 O-C-N 124.698 1.249 . . . . 0.0 111.999 177.076 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.599 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 20.0 t -61.19 -52.63 64.01 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.643 0.777 . . . . 0.0 111.653 -173.502 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.9 OUTLIER -74.25 -33.42 63.32 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.315 178.083 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -52.35 -42.29 63.77 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.826 0.851 . . . . 0.0 112.637 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -80.14 -38.49 31.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -177.929 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.8 t60 -48.26 -34.19 9.93 Favored 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 162.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.41 -35.14 70.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 172.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -61.03 -27.41 68.31 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 167.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -68.98 -31.15 69.79 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.845 0.458 . . . . 0.0 110.243 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 26.6 m80 . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 123.41 0.684 . . . . 0.0 111.261 173.282 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 61.0 p . . . . . 0 CA--C 1.526 0.046 0 CA-C-O 121.302 0.572 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.0 t -76.35 126.5 31.11 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.046 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.45 -27.83 69.38 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.526 0.603 . . . . 0.0 111.462 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mt -88.24 -44.08 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.968 -170.785 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -131.69 -2.73 3.74 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 119.231 0.923 . . . . 0.0 112.335 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.17 31.72 56.51 Favored Glycine 0 C--N 1.362 2.001 0 N-CA-C 115.004 0.762 . . . . 0.0 115.004 174.493 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -62.61 -23.4 67.03 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.598 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm 77.8 118.62 0.06 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.826 1.25 . . . . 0.0 111.228 175.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -125.7 162.57 24.73 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.69 0.796 . . . . 0.0 111.832 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -72.3 -32.5 66.65 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.856 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -150.14 165.34 33.13 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-O 121.014 0.435 . . . . 0.0 111.395 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -56.13 -40.66 74.11 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.931 1.293 . . . . 0.0 111.528 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.87 -41.97 68.1 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.045 0.841 . . . . 0.0 111.503 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.0 m -66.13 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.647 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.9 t -76.3 -42.9 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 C-N-CA 123.728 0.811 . . . . 0.0 110.11 -174.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.7 -41.39 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.301 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.74 -36.58 80.83 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 113.966 -1.47 . . . . 0.0 109.742 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -68.25 -45.15 73.99 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.572 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 ttpt -70.16 -40.26 74.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.693 0.797 . . . . 0.0 109.715 -167.955 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.3 -30.38 66.6 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.061 177.69 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -102.76 -40.64 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.46 0.704 . . . . 0.0 111.742 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.2 t -85.95 -17.78 34.45 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.611 1.165 . . . . 0.0 111.158 -170.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 . . . . . 0 CA--C 1.567 1.629 0 C-N-CA 123.006 0.522 . . . . 0.0 111.043 -176.498 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? . . . . . 0 N--CA 1.496 1.859 0 CA-C-O 121.398 0.618 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -128.14 94.23 3.86 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.196 0.998 . . . . 0.0 108.817 -167.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.3 118.77 20.11 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 126.111 1.764 . . . . 0.0 109.077 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.643 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -114.64 151.13 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -173.198 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.648 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 2.2 t -81.61 -23.53 36.97 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.712 0.805 . . . . 0.0 111.281 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.643 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.1 tt0 85.87 -5.46 0.82 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.491 1.516 . . . . 0.0 110.288 174.202 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -134.76 -51.01 0.78 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.447 0.699 . . . . 0.0 109.311 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -144.27 79.37 1.61 Allowed 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.003 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -163.24 129.29 3.25 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.748 1.219 . . . . 0.0 109.293 164.72 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.469 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 35.3 ptt180 -66.61 -59.68 3.39 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.184 0.927 . . . . 0.0 108.731 175.694 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -176.22 146.45 0.66 Allowed 'General case' 0 C--N 1.354 0.777 0 C-N-CA 124.941 1.296 . . . . 0.0 108.519 169.61 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -119.34 139.13 52.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 173.581 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -89.42 0.38 56.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.313 0.245 . . . . 0.0 110.863 174.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 m -137.75 133.01 33.61 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.282 0.633 . . . . 0.0 110.052 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.8 p -61.79 -38.5 88.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.382 1.073 . . . . 0.0 111.526 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.481 ' O ' HG23 ' A' ' 31' ' ' VAL . 51.7 m-70 -62.48 -40.17 95.8 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.993 0.517 . . . . 0.0 111.47 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.79 -45.11 95.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.718 0.807 . . . . 0.0 110.175 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.42 -40.96 98.26 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.957 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.05 -30.32 71.27 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.227 0.611 . . . . 0.0 111.896 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 27' ' ' HIS . 81.2 t -65.98 -41.54 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.46 0.704 . . . . 0.0 110.465 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -68.44 -40.39 81.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.559 0.744 . . . . 0.0 110.83 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -65.09 -3.34 3.57 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.928 1.291 . . . . 0.0 112.128 -175.116 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -45.16 -24.41 0.25 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 125.193 1.397 . . . . 0.0 114.115 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.6 tp -87.2 -40.47 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 C-N-CA 124.323 1.049 . . . . 0.0 110.598 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -98.57 -19.04 17.82 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -172.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -62.03 -49.06 77.51 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -158.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.97 -31.1 3.75 Favored Glycine 0 C--N 1.338 0.665 0 CA-C-O 120.06 -0.3 . . . . 0.0 112.68 -164.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -111.17 78.85 1.15 Allowed 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 172.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -58.12 121.89 54.48 Favored Pre-proline 0 N--CA 1.478 0.957 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.099 -174.627 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -63.47 -86.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.741 2.294 . . . . 0.0 111.981 -172.468 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -145.55 100.65 3.47 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -142.18 126.95 18.11 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.371 0.668 . . . . 0.0 109.743 -176.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 t -64.67 109.4 2.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.872 1.269 . . . . 0.0 111.27 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -87.6 49.26 1.77 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.759 1.224 . . . . 0.0 110.085 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mm -133.9 -3.47 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.606 0 C-N-CA 125.528 1.531 . . . . 0.0 108.004 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.2 p 179.66 -133.44 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 102.745 -3.058 . . . . 0.0 102.745 -165.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.486 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.68 129.55 3.24 Favored Glycine 0 C--N 1.306 -1.117 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 161.118 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -176.79 113.29 0.1 Allowed 'General case' 0 C--N 1.354 0.803 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 -170.281 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 m -115.55 140.68 48.94 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 63.0 m -133.01 161.58 33.99 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.555 1.142 . . . . 0.0 110.875 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -97.24 -31.88 12.2 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.148 0.979 . . . . 0.0 109.462 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -97.28 130.71 44.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.152 0.981 . . . . 0.0 110.227 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -57.73 -44.03 85.7 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.57 1.148 . . . . 0.0 111.416 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.73 -40.56 69.39 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.591 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 t -56.92 -55.43 34.6 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.738 0.815 . . . . 0.0 112.302 -175.328 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.474 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -75.83 -27.94 58.07 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 119.332 -0.366 . . . . 0.0 111.673 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 61' ' ' MET . 6.3 t30 -58.92 -39.82 82.7 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.787 0.835 . . . . 0.0 112.744 175.268 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -79.69 -45.94 18.04 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 68.7 t60 -48.21 -37.73 16.61 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 168.03 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -72.09 -35.22 69.15 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 119.647 1.112 . . . . 0.0 110.759 178.105 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.45 -31.4 72.11 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.058 0.543 . . . . 0.0 111.277 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -58.54 -30.32 67.01 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.933 173.535 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 54.3 m80 . . . . . 0 N--CA 1.49 1.549 0 C-N-CA 123.064 0.546 . . . . 0.0 111.798 175.513 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 77.2 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 121.541 0.686 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.735 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 5.1 t -100.32 124.18 45.47 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 170.256 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -70.56 -5.4 28.78 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.246 0.475 . . . . 0.0 111.739 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.5 -32.13 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.725 0.81 . . . . 0.0 109.15 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.4 p -170.32 70.59 0.06 Allowed 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLY . . . . . 0.735 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -39.46 76.5 0.0 OUTLIER Glycine 0 N--CA 1.48 1.567 0 N-CA-C 117.672 1.829 . . . . 0.0 117.672 175.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -66.68 -21.87 66.09 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.185 0.994 . . . . 0.0 111.264 171.226 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm 70.86 103.2 0.06 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.987 1.315 . . . . 0.0 109.628 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.403 ' HB3' ' HB3' ' A' ' 86' ' ' SER . 70.2 m-85 -107.41 160.53 15.57 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.297 0.639 . . . . 0.0 111.55 -167.395 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.51 -38.66 81.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.361 1.065 . . . . 0.0 112.629 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -166.66 172.73 10.32 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 123.831 0.707 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -55.6 -34.57 64.98 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.284 1.433 . . . . 0.0 112.578 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -54.86 -45.72 74.6 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 123.801 0.688 . . . . 0.0 111.182 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.403 ' HB3' ' HB3' ' A' ' 81' ' ' PHE . 26.3 t -69.81 -30.83 68.45 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.728 0.642 . . . . 0.0 111.107 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.7 t -73.31 -44.61 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 0.0 109.98 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.43 -38.07 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 113.731 -1.577 . . . . 0.0 109.169 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.19 -38.48 82.06 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.772 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -66.67 -49.69 65.34 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.448 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -70.82 -39.3 73.11 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.031 0.532 . . . . 0.0 110.113 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.96 -23.91 67.36 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.081 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -99.23 -44.49 6.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 123.332 0.395 . . . . 0.0 111.425 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.9 t -82.14 -26.73 33.25 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.457 1.103 . . . . 0.0 111.204 -173.219 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 . . . . . 0 CA--C 1.558 1.254 0 C-N-CA 122.707 0.403 . . . . 0.0 111.49 -175.199 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 . . . . . 0 N--CA 1.475 0.799 0 CA-C-O 121.672 0.749 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.453 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 6.6 p-10 -149.68 98.86 2.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.035 -170.321 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -76.97 119.74 21.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.618 -1.628 . . . . 0.0 109.663 174.83 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -105.03 149.18 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.777 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 1.4 t -83.6 163.39 20.39 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.611 0.72 . . . . 0.0 110.283 176.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 31.5 tt0 -58.4 -32.76 68.93 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.523 -1.671 . . . . 0.0 111.217 -176.898 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -138.4 -49.52 0.55 Allowed 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.097 0.559 . . . . 0.0 109.978 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.2 p -124.84 72.18 1.21 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.605 -169.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.777 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -141.65 135.09 29.59 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.983 150.495 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -69.19 -58.94 3.39 Favored 'General case' 0 CA--C 1.555 1.145 0 O-C-N 124.241 0.963 . . . . 0.0 109.483 168.575 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . -172.99 133.4 0.54 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 123.567 0.747 . . . . 0.0 111.083 170.483 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -114.35 130.75 56.69 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.854 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -80.29 3.73 20.02 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 118.44 0.564 . . . . 0.0 111.738 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -137.4 134.88 36.42 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.138 0.975 . . . . 0.0 109.827 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.4 p -69.14 -28.83 66.8 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.832 0.853 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 31' ' ' VAL . 67.9 t60 -62.97 -44.29 96.46 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.176 0.59 . . . . 0.0 110.252 176.213 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -53.7 -51.28 63.78 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.119 0.968 . . . . 0.0 111.464 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.8 tp -67.7 -34.86 77.72 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.287 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.43 88.26 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.056 0.543 . . . . 0.0 111.004 176.51 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.664 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 61.8 t -65.17 -36.67 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.553 175.681 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -65.28 -40.98 94.58 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.026 0.93 . . . . 0.0 110.75 174.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.472 ' HG2' ' HB2' ' A' ' 36' ' ' HIS . 17.2 ttt180 -75.08 9.74 1.83 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 123.907 0.883 . . . . 0.0 111.505 -174.441 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.538 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 25.7 ptt? -49.68 -27.47 4.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.307 1.443 . . . . 0.0 113.705 169.037 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ILE . . . . . 0.412 HG22 ' H ' ' A' ' 35' ' ' ILE . 3.8 tp -86.82 -29.15 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.225 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' HIS . . . . . 0.472 ' HB2' ' HG2' ' A' ' 33' ' ' ARG . 22.6 m80 -99.9 -60.24 1.57 Allowed 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -167.7 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -104.35 24.99 10.7 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -149.736 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.95 43.26 34.68 Favored Glycine 0 N--CA 1.478 1.497 0 C-N-CA 119.872 -1.156 . . . . 0.0 113.496 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 34' ' ' MET . 11.1 mm-40 -146.75 114.99 6.64 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 124.592 1.157 . . . . 0.0 108.229 -166.264 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -112.4 94.0 25.2 Favored Pre-proline 0 N--CA 1.472 0.665 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 167.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.664 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 28.3 Cg_endo -58.32 -67.21 0.06 OUTLIER 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 123.543 2.829 . . . . 0.0 112.188 -174.092 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 54' ' ' LYS . 86.3 mt -146.23 90.88 2.0 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.757 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -136.48 135.6 38.72 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.794 0.437 . . . . 0.0 111.904 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.515 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 7.5 t -71.58 105.35 3.61 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.698 1.199 . . . . 0.0 109.725 171.435 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -93.27 49.49 1.41 Allowed 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.574 1.178 . . . . 0.0 110.185 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 3.1 mp -114.57 -55.31 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 169.516 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 21.3 p -112.7 -113.03 0.33 Allowed 'General case' 0 C--O 1.238 0.462 0 N-CA-C 103.997 -2.594 . . . . 0.0 103.997 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -148.32 154.63 25.98 Favored Glycine 0 C--N 1.313 -0.742 0 N-CA-C 108.626 -1.79 . . . . 0.0 108.626 152.972 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.9 t80 172.48 114.37 0.01 OUTLIER 'General case' 0 C--N 1.351 0.662 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -173.802 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.1 m -129.4 138.31 51.42 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 52' ' ' ARG . 52.0 t -136.36 167.13 21.91 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.131 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.418 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 16.8 tpp85 -70.44 -33.82 71.75 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.239 176.384 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -121.43 134.04 55.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.376 0.67 . . . . 0.0 109.918 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.516 ' HB2' HD22 ' A' ' 42' ' ' LEU . 5.5 ttpm? -59.29 -21.76 60.16 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.495 0.718 . . . . 0.0 111.374 174.979 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.98 -28.13 15.74 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.647 1.179 . . . . 0.0 112.582 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -77.52 -55.0 5.74 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.27 0.628 . . . . 0.0 112.358 175.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.575 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -75.86 -34.55 60.04 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -171.85 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 61' ' ' MET . 1.3 p-10 -55.51 -37.48 67.95 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.506 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 45.8 p-90 -86.04 -35.85 20.07 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 118.251 0.478 . . . . 0.0 111.02 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 65.8 t60 -48.26 -32.23 6.98 Favored 'General case' 0 CA--C 1.572 1.822 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 171.152 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.402 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 23.8 ptp -69.48 -32.19 70.94 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.935 -1.103 . . . . 0.0 112.35 170.612 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 39.3 ttmt -58.11 -29.17 65.28 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 122.921 0.488 . . . . 0.0 111.457 169.507 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 31.2 mmmt -63.61 -38.09 89.8 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.916 0.486 . . . . 0.0 110.61 175.53 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 51.8 m80 . . . . . 0 N--CA 1.481 1.125 0 C-N-CA 123.116 0.567 . . . . 0.0 110.281 177.335 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.0 m . . . . . 0 C--O 1.235 0.317 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 9.8 t -87.19 105.63 17.33 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.831 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -58.74 -8.79 1.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.4 mt -93.9 -48.05 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 123.553 0.741 . . . . 0.0 112.156 178.089 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 15.9 p -132.06 5.39 4.17 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.35 34.83 59.79 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 123.563 0.601 . . . . 0.0 114.366 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.438 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 8.1 tmtm? -65.21 -28.86 69.66 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.063 0.545 . . . . 0.0 111.712 -174.181 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 71.08 116.62 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.658 1.183 . . . . 0.0 110.872 172.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.414 ' CZ ' ' HD2' ' A' ' 79' ' ' LYS . 89.5 m-85 -127.46 160.34 31.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.623 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.47 -40.14 95.14 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.91 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -136.59 154.59 50.64 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 123.277 0.631 . . . . 0.0 109.981 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -59.93 -31.19 69.62 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.347 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.55 -45.16 81.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.62 0.768 . . . . 0.0 110.714 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.5 m -67.87 -30.82 70.29 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 123.77 0.669 . . . . 0.0 111.776 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.29 -48.53 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 C-N-CA 123.431 0.692 . . . . 0.0 110.425 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.0 t -73.68 -35.07 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 109.657 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.36 95.42 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.282 173.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -72.81 -34.74 67.07 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.689 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -73.78 -36.81 65.1 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.316 0.647 . . . . 0.0 109.823 -176.368 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.38 -38.54 89.98 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.033 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -97.01 -46.85 6.03 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -169.462 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.3 t -80.28 -20.74 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.633 0.773 . . . . 0.0 110.673 -173.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 9.4 m80 . . . . . 0 CA--C 1.561 1.399 0 C-N-CA 123.147 0.579 . . . . 0.0 109.532 -176.74 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -143.54 94.82 2.65 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.746 1.26 . . . . 0.0 108.786 -166.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -99.84 133.52 44.08 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 113.516 -1.675 . . . . 0.0 109.57 -174.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 17' ' ' GLU . 6.7 mm -115.18 149.49 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.603 0.761 . . . . 0.0 109.582 -166.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.62 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.8 t -85.49 -20.39 29.79 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.531 0.732 . . . . 0.0 109.979 174.064 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.703 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.7 tt0 85.95 -3.97 0.79 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 126.235 1.814 . . . . 0.0 111.19 171.095 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -135.87 -49.2 0.69 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -136.21 77.14 1.64 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.357 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.62 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -170.85 128.04 0.75 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.605 1.162 . . . . 0.0 109.394 163.354 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.418 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 34.1 ptt180 -68.86 -58.25 4.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.159 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.418 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -173.2 152.85 2.34 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 124.135 0.974 . . . . 0.0 109.616 164.48 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -125.94 152.05 46.15 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.558 1.143 . . . . 0.0 108.29 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -59.03 -30.31 67.93 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 m -143.21 156.11 44.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.269 0.628 . . . . 0.0 110.98 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.577 ' HA ' HD23 ' A' ' 29' ' ' LEU . 41.9 m -57.11 -36.52 70.73 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.608 171.726 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -74.13 -35.41 64.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.087 0.555 . . . . 0.0 110.732 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.78 -47.21 86.59 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.405 0.682 . . . . 0.0 110.467 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.577 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.2 OUTLIER -66.98 -28.99 68.71 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.828 0.851 . . . . 0.0 110.747 174.232 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.71 -27.52 69.27 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.936 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.11 -41.45 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 122.749 0.42 . . . . 0.0 110.212 173.688 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -64.92 -38.45 91.01 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.703 0.801 . . . . 0.0 110.222 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 24.9 ttt85 -70.03 5.95 1.42 Allowed 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 124.859 1.263 . . . . 0.0 111.723 -176.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.0 ptm -46.11 -18.4 0.05 Allowed 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 125.314 1.446 . . . . 0.0 113.574 171.192 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.98 -52.88 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.919 0 C-N-CA 125.403 1.481 . . . . 0.0 110.428 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -100.42 6.45 44.42 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.535 0.734 . . . . 0.0 112.65 -172.861 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.421 HG21 ' HA ' ' A' ' 40' ' ' LYS . 3.4 t -58.88 -55.4 35.58 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -163.052 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.08 -31.41 3.13 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-O 120.083 -0.287 . . . . 0.0 112.62 -171.811 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -86.75 -48.54 8.16 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.883 0.873 . . . . 0.0 110.886 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' HG21 ' A' ' 37' ' ' THR . 60.5 mttp 70.3 122.75 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 126.107 1.763 . . . . 0.0 111.429 -168.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.27 -170.84 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.217 0 C-N-CA 121.979 1.786 . . . . 0.0 110.679 164.388 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 54' ' ' LYS . 95.4 mt -92.38 98.22 11.35 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -122.46 130.15 52.77 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.389 1.076 . . . . 0.0 110.134 -167.013 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.463 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 21.1 t -69.0 107.05 2.98 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.33 170.103 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.49 27.28 0.44 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.581 1.152 . . . . 0.0 111.693 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.463 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 21.8 mm -118.82 -3.31 9.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.479 1.112 . . . . 0.0 108.773 -168.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.4 p 179.93 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.523 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 -169.029 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.26 135.47 5.24 Favored Glycine 0 C--N 1.309 -0.918 0 N-CA-C 107.142 -2.383 . . . . 0.0 107.142 158.356 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -179.36 111.86 0.05 Allowed 'General case' 0 C--N 1.346 0.431 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.2 m -128.71 146.52 50.86 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -166.859 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 t -157.48 179.04 9.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.595 -177.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -110.52 -3.43 16.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.409 0.684 . . . . 0.0 110.149 169.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -106.02 104.64 14.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 172.44 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.5 pttt -57.64 -33.54 68.39 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.622 0.769 . . . . 0.0 112.801 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.41 -41.73 69.63 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.758 0.823 . . . . 0.0 112.097 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.3 m -52.08 -52.87 48.46 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.088 0.955 . . . . 0.0 112.616 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.466 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -77.85 -31.49 51.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.607 0.763 . . . . 0.0 111.995 177.77 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.69 -44.0 97.06 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.575 0.75 . . . . 0.0 112.968 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -81.03 -36.84 30.04 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -51.57 -30.72 21.88 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.456 1.102 . . . . 0.0 113.683 165.931 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 28.5 ttt -71.6 -39.57 70.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.102 0.561 . . . . 0.0 111.357 173.854 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -58.77 -34.43 71.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.273 0.629 . . . . 0.0 110.654 168.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -64.19 -29.42 70.53 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.628 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 38.1 m80 . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.882 -0.511 . . . . 0.0 111.794 172.815 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.9 t -70.69 114.03 8.37 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 169.008 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -60.12 -13.89 14.24 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -172.918 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mt -104.38 -31.41 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -175.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 19.4 p -136.2 -4.95 2.11 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.765 -1.209 . . . . 0.0 113.389 -178.001 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.05 33.75 85.26 Favored Glycine 0 C--N 1.347 1.185 0 C-N-CA 123.039 0.352 . . . . 0.0 113.381 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.541 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.0 tmtt? -65.76 -35.13 79.85 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.03 0.932 . . . . 0.0 112.103 -176.343 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? 73.67 120.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.816 1.246 . . . . 0.0 110.4 -176.625 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -128.56 162.42 27.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.913 0.885 . . . . 0.0 109.861 175.203 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 8.1 mm-40 -70.69 -28.3 64.66 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.437 0.695 . . . . 0.0 112.673 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HD3' ' HB2' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -144.39 151.22 38.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.122 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -66.2 -25.1 66.77 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.632 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.65 -28.29 65.76 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 49.4 m -67.48 -31.7 72.03 Favored 'General case' 0 C--N 1.359 1.012 0 O-C-N 122.952 0.157 . . . . 0.0 110.923 171.894 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.4 t -75.15 -47.69 34.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.002 0.921 . . . . 0.0 110.196 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 70.6 t -73.34 -35.94 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.081 1.352 . . . . 0.0 109.959 -174.36 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.89 95.33 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.951 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 90' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 86' ' ' SER . 2.3 t60 -71.41 -30.18 65.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.873 178.819 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.6 -41.0 69.47 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.412 1.085 . . . . 0.0 109.603 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.36 64.36 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.125 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -105.58 -42.03 5.31 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.219 0.608 . . . . 0.0 112.34 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.8 t -93.26 -23.08 18.64 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.096 0.958 . . . . 0.0 111.306 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 . . . . . 0 CA--C 1.57 1.732 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.057 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.4 ttt-85 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 122.563 1.173 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -164.71 114.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -168.374 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -121.54 120.62 35.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.792 0.837 . . . . 0.0 110.715 -178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 43.0 mm -100.95 110.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.097 -177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.7 t -61.97 90.82 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 158.473 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 18.47 -59.44 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 129.101 2.96 . . . . 0.0 116.563 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -121.35 -39.28 2.69 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.474 -165.046 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.25 -23.36 19.35 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.77 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.32 125.88 35.3 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -170.829 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.432 ' CD ' ' H ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -69.62 -52.01 29.77 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.029 163.374 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -177.43 138.17 0.22 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 125.24 1.416 . . . . 0.0 108.568 160.555 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -105.02 151.81 23.5 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -63.29 -34.71 78.27 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.309 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 m -146.95 154.44 41.27 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 121.124 0.488 . . . . 0.0 111.817 -169.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 p -61.03 -45.31 95.3 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.72 1.208 . . . . 0.0 112.142 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -68.78 -35.63 77.29 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.26 -51.69 67.2 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.505 0.722 . . . . 0.0 111.106 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -37.11 85.12 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.984 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.06 -29.23 68.41 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 124.137 0.898 . . . . 0.0 112.532 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.99 -45.21 95.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.219 0.608 . . . . 0.0 110.972 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -35.83 70.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.333 0.653 . . . . 0.0 109.479 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.644 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 39.1 ttt85 -61.96 -8.08 4.68 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.348 1.459 . . . . 0.0 112.361 -175.827 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.41 ' HA ' ' HB ' ' A' ' 37' ' ' THR . 23.0 ptm -46.04 -12.55 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 -178.159 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -53.42 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 C-N-CA 124.587 1.155 . . . . 0.0 108.641 172.846 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -101.82 14.37 32.14 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.399 1.479 . . . . 0.0 112.435 -176.161 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.644 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 13.5 t -57.89 -70.47 0.13 Allowed 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -154.284 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.03 32.86 81.8 Favored Glycine 0 N--CA 1.479 1.541 0 CA-C-N 118.994 0.815 . . . . 0.0 111.099 -169.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.446 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 10.6 mm-40 -147.5 -42.31 0.17 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.517 1.927 . . . . 0.0 106.913 -172.777 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? 61.5 96.67 0.04 OUTLIER Pre-proline 0 C--N 1.356 0.878 0 C-N-CA 126.067 1.747 . . . . 0.0 112.245 174.019 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.07 -173.23 1.6 Allowed 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.4 2.067 . . . . 0.0 110.185 161.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -120.3 118.47 30.49 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.802 0.441 . . . . 0.0 110.064 -175.519 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -116.06 148.78 39.85 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.577 0.751 . . . . 0.0 109.664 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.8 t -66.37 107.74 2.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.475 0.71 . . . . 0.0 109.962 167.285 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -75.91 8.71 2.89 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.646 0.779 . . . . 0.0 112.893 -178.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.464 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 39.2 mm -88.77 -56.24 5.44 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.653 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.505 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.3 p -119.44 -107.76 0.37 Allowed 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 104.139 -2.541 . . . . 0.0 104.139 175.155 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.505 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.16 164.18 29.24 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 160.097 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.0 t80 167.47 112.61 0.01 OUTLIER 'General case' 0 C--N 1.353 0.725 0 N-CA-C 103.379 -2.822 . . . . 0.0 103.379 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m -117.1 135.31 53.84 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.577 0.703 . . . . 0.0 109.765 -165.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.4 t -151.89 164.4 37.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.837 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -81.57 -31.14 32.74 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.069 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -103.99 127.18 51.54 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.372 1.069 . . . . 0.0 109.487 -173.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -55.86 -30.21 61.14 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.723 0.639 . . . . 0.0 112.029 175.647 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.52 83.44 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.397 1.079 . . . . 0.0 112.901 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -59.97 -54.36 46.94 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.343 0.657 . . . . 0.0 111.674 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.5 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -75.43 -24.11 57.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 123.744 0.818 . . . . 0.0 112.013 177.605 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -52.0 -42.98 63.43 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.553 0.741 . . . . 0.0 112.751 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -79.67 -48.37 13.81 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 83.2 t60 -48.52 -39.98 25.2 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.157 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.01 -37.53 72.63 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 119.991 1.268 . . . . 0.0 110.551 175.861 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -65.24 -26.35 68.07 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.532 0.733 . . . . 0.0 111.496 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -35.54 79.44 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 51.3 m80 . . . . . 0 N--CA 1.485 1.311 0 C-N-CA 123.136 0.574 . . . . 0.0 111.659 178.133 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.544 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 68.8 p . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 37.2 t -123.6 97.31 5.32 Favored 'General case' 0 C--O 1.2 -1.534 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -56.72 -14.83 3.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -169.245 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 mt -87.35 -22.87 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.749 0.419 . . . . 0.0 111.474 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.642 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.4 p -147.56 4.14 0.77 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 53.09 37.02 53.45 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.161 0.886 . . . . 0.0 114.72 -177.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.1 tmtt? -66.3 -37.91 86.5 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 111.646 -172.228 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 71.5 mmtt 72.25 117.02 0.05 OUTLIER 'General case' 0 C--N 1.362 1.15 0 C-N-CA 124.797 1.239 . . . . 0.0 110.11 176.751 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.413 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.6 m-85 -125.31 164.99 19.17 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.57 -39.51 94.57 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 114.408 -1.269 . . . . 0.0 111.54 176.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -145.8 155.83 43.18 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.021 0.528 . . . . 0.0 110.023 -177.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.9 pptp? -64.34 -24.42 67.64 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.102 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.52 -47.1 80.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.062 0.545 . . . . 0.0 110.484 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -65.81 -30.77 71.45 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.423 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 86.5 t -72.92 -49.26 40.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.714 0.805 . . . . 0.0 110.194 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.78 -35.37 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.963 1.305 . . . . 0.0 109.182 -174.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.52 -44.41 94.32 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.517 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.05 -35.0 66.62 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.42 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -69.83 -38.81 76.65 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.277 1.031 . . . . 0.0 109.244 -172.021 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.24 -23.07 66.35 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.459 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -91.94 -50.82 5.51 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 121.197 0.522 . . . . 0.0 110.423 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.7 t -85.12 -23.92 28.24 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.825 1.25 . . . . 0.0 111.795 -169.14 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 16.1 m80 . . . . . 0 CA--C 1.562 1.439 0 C-N-CA 122.557 0.343 . . . . 0.0 111.715 -172.779 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 59.85 95.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.117 1.367 . . . . 0.0 111.707 -177.646 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.27 113.11 24.69 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -177.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.4 mm -105.54 157.05 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.22 0.608 . . . . 0.0 109.576 -167.334 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.622 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 23.4 t -90.85 12.21 20.12 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.679 0.391 . . . . 0.0 111.205 173.396 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 87.54 -38.88 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.761 1.624 . . . . 0.0 110.08 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -137.41 -55.26 0.69 Allowed 'General case' 0 C--N 1.351 0.664 0 C-N-CA 122.73 0.412 . . . . 0.0 110.028 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 p -94.82 58.86 2.31 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.622 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.14 142.24 4.94 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.003 0.921 . . . . 0.0 110.46 160.724 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 10.2 ptp180 -68.0 -58.55 4.34 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 118.982 -0.532 . . . . 0.0 109.621 167.792 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.419 ' N ' ' HG3' ' A' ' 21' ' ' ARG . . . 174.28 134.87 0.04 OUTLIER 'General case' 0 C--N 1.358 0.961 0 C-N-CA 125.738 1.615 . . . . 0.0 108.0 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -108.46 164.52 12.27 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -56.4 -44.53 80.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.934 1.294 . . . . 0.0 111.339 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.0 m -146.21 168.59 20.65 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.301 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.528 ' HA ' HD23 ' A' ' 29' ' ' LEU . 51.0 p -64.62 -39.24 93.37 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.275 1.03 . . . . 0.0 112.617 -176.967 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -75.13 -37.0 61.57 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.395 0.678 . . . . 0.0 110.909 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.49 -41.93 73.71 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.911 0.885 . . . . 0.0 110.581 167.999 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -72.8 -33.81 66.48 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.899 178.236 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.628 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -62.75 -28.23 69.83 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.336 1.055 . . . . 0.0 111.9 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.2 t -50.29 -46.65 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 123.834 0.709 . . . . 0.0 111.49 168.593 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -77.06 -45.66 26.34 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.349 171.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.628 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 56.8 ttt180 -79.04 40.21 0.4 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.289 1.435 . . . . 0.0 110.155 -170.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -60.7 -52.77 63.69 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 123.824 0.85 . . . . 0.0 112.405 -162.155 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.2 tp -85.16 -17.89 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 19.5 m80 -84.33 -42.3 15.91 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 120.613 1.552 . . . . 0.0 109.734 -156.7 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.3 t -70.9 -27.36 63.74 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 114.768 -1.106 . . . . 0.0 113.405 -165.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.58 33.88 12.69 Favored Glycine 0 C--N 1.342 0.874 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.183 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -110.83 -30.56 7.5 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.285 1.034 . . . . 0.0 109.98 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.9 pttt 44.55 72.84 1.09 Allowed Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 126.323 1.849 . . . . 0.0 112.572 -171.268 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.72 147.41 94.75 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.508 2.139 . . . . 0.0 111.581 175.41 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 50' ' ' THR . 91.2 mt -80.64 137.12 36.32 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -171.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.456 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 61.7 tt0 -117.65 139.3 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -168.254 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.715 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 1.8 t -64.28 112.79 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.936 0.894 . . . . 0.0 110.79 173.917 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -82.02 26.63 0.51 Allowed 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.689 0.796 . . . . 0.0 112.773 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 25.7 mm -105.64 -53.17 7.02 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 169.34 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.542 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 27.3 p -118.5 -109.33 0.36 Allowed 'General case' 0 C--N 1.346 0.443 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 173.864 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.542 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.02 165.92 29.35 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 108.624 -1.79 . . . . 0.0 108.624 155.13 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.688 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 23.8 t80 175.61 111.7 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -105.64 125.58 51.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -171.996 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.5 t -143.13 165.8 26.42 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.343 0.657 . . . . 0.0 111.622 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -70.18 -42.72 72.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.903 1.281 . . . . 0.0 110.835 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -110.98 131.37 55.1 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.548 0.739 . . . . 0.0 110.525 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -50.86 -37.26 42.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.793 1.237 . . . . 0.0 111.447 172.721 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -36.95 52.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.254 1.022 . . . . 0.0 112.515 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.8 m -69.47 -55.97 8.74 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.451 0.301 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -41.82 45.03 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -173.126 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -50.25 -54.18 22.99 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.769 0.827 . . . . 0.0 111.77 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.536 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 58.6 m95 -78.27 -33.92 49.28 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.331 -172.848 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 3.2 t-80 -45.1 -41.17 7.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 124.049 0.843 . . . . 0.0 112.617 163.908 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.715 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 33.6 mtm -61.85 -48.01 82.49 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 117.465 0.121 . . . . 0.0 110.892 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.79 -39.54 77.77 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.102 0.876 . . . . 0.0 111.014 176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 31.4 mmmt -59.42 -45.73 90.71 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 124.208 0.943 . . . . 0.0 110.221 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.197 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -172.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 32.6 p . . . . . 0 C--O 1.24 0.589 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.0 t -86.91 124.29 32.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -62.68 -25.86 68.36 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.987 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -92.44 -42.99 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.013 0.525 . . . . 0.0 112.221 -172.651 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.14 8.4 2.94 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 119.628 1.104 . . . . 0.0 113.142 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.4 37.43 18.71 Favored Glycine 0 N--CA 1.483 1.797 0 N-CA-C 117.769 1.868 . . . . 0.0 117.769 165.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -68.54 -26.98 65.7 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.855 0.827 . . . . 0.0 113.047 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.0 OUTLIER 77.61 121.36 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.667 1.587 . . . . 0.0 110.263 -172.335 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -119.32 170.19 9.33 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.945 0.898 . . . . 0.0 110.554 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.688 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 1.7 mm-40 -68.93 -28.64 66.83 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.799 -175.141 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -162.58 165.77 25.54 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.935 0.894 . . . . 0.0 109.31 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -60.65 -37.39 81.38 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.106 0.962 . . . . 0.0 111.009 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.85 -37.85 88.91 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.195 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.5 m -66.01 -29.97 70.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.966 0.506 . . . . 0.0 111.146 177.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 75.8 t -73.68 -48.58 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.268 1.027 . . . . 0.0 110.237 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.0 t -73.61 -34.48 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.874 -175.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.2 86.35 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.27 174.109 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -72.46 -32.65 66.43 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.346 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -70.23 -36.68 74.68 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.255 1.022 . . . . 0.0 109.362 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.36 83.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.749 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -87.97 -47.76 8.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.386 -171.362 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.6 t -104.13 -6.23 21.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.994 0.917 . . . . 0.0 111.763 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 . . . . . 0 CA--C 1.57 1.736 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.687 176.848 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 121.799 0.809 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -148.53 95.5 2.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.8 1.24 . . . . 0.0 107.747 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -93.92 102.58 14.68 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.419 -178.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.0 mm -101.75 104.83 16.94 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.605 -166.505 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 18' ' ' TYR . 7.6 t -60.04 92.95 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 160.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 32.23 -62.23 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 128.772 2.829 . . . . 0.0 115.502 166.771 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 16' ' ' CYS . 3.2 t80 -134.67 -41.9 0.77 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.616 0.767 . . . . 0.0 110.155 -175.663 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -97.79 34.59 1.85 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.181 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.37 122.54 26.52 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.783 0.433 . . . . 0.0 111.126 159.267 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -69.37 -53.01 21.67 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 168.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -174.69 125.8 0.29 Allowed 'General case' 0 C--N 1.362 1.141 0 C-N-CA 123.926 0.89 . . . . 0.0 109.868 163.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -96.82 146.49 24.87 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -67.05 -29.81 69.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.946 0.499 . . . . 0.0 111.164 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -162.59 158.21 23.07 Favored 'General case' 0 CA--C 1.557 1.241 0 CA-C-O 120.993 0.425 . . . . 0.0 111.158 -173.426 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.8 p -65.25 -31.06 72.02 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -74.42 -36.7 63.46 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.359 0.527 . . . . 0.0 111.043 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -58.72 -48.29 81.65 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.697 1.237 . . . . 0.0 109.606 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.23 -43.53 78.7 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.801 -2.0 . . . . 0.0 112.383 169.86 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -57.9 -29.42 65.07 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.801 0.84 . . . . 0.0 112.679 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 50' ' ' THR . 61.1 t -61.05 -46.82 95.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.488 0.715 . . . . 0.0 110.532 176.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -73.81 -39.61 63.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.86 0.864 . . . . 0.0 111.069 174.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.408 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 43.0 ttt180 -69.35 -1.93 9.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.685 1.194 . . . . 0.0 111.965 -173.562 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.543 ' SD ' ' NE2' ' A' ' 43' ' ' GLN . 24.9 ptt? -45.38 -16.5 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.985 1.714 . . . . 0.0 114.79 174.156 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -86.77 -56.89 4.75 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.706 0 C-N-CA 125.379 1.471 . . . . 0.0 110.046 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.83 6.43 36.59 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -172.003 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.66 HG21 ' HD3' ' A' ' 41' ' ' PRO . 5.2 t -62.15 -49.66 74.97 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -169.212 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.28 -30.33 3.71 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 119.917 -0.38 . . . . 0.0 112.735 -169.885 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -70.03 -16.47 63.16 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.087 0.955 . . . . 0.0 113.217 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.08 82.14 0.24 Allowed Pre-proline 0 CA--C 1.563 1.476 0 C-N-CA 125.279 1.431 . . . . 0.0 112.706 -176.745 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PRO . . . . . 0.66 ' HD3' HG21 ' A' ' 37' ' ' THR . 2.1 Cg_endo -83.3 173.58 9.7 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.292 2.661 . . . . 0.0 110.482 172.291 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 mp -97.92 131.37 44.44 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -173.669 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' SD ' ' A' ' 34' ' ' MET . 33.4 tt0 -120.32 141.42 50.04 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.733 0.413 . . . . 0.0 110.503 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.7 t -64.65 108.53 1.73 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.645 0.778 . . . . 0.0 109.573 169.724 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.83 6.28 2.66 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.32 1.048 . . . . 0.0 112.644 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.594 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 mp -90.73 -51.59 11.6 Favored 'Isoleucine or valine' 0 C--N 1.354 0.802 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -174.149 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 25.0 p -119.94 -112.75 0.33 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.36 158.27 27.66 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 108.253 -1.939 . . . . 0.0 108.253 157.026 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.7 t80 172.04 110.46 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 102.216 -3.253 . . . . 0.0 102.216 -175.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 31' ' ' VAL . 2.7 m -119.64 137.12 54.08 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -167.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 8.1 p -160.11 155.93 25.96 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.994 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 2.68 45.05 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.515 175.044 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -105.21 103.99 13.63 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 124.548 1.139 . . . . 0.0 108.345 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -50.73 -45.36 58.61 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.373 0.669 . . . . 0.0 111.268 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.65 -39.78 68.37 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.424 1.077 . . . . 0.0 112.783 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.499 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 22.9 t -61.47 -54.9 37.34 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.231 0.612 . . . . 0.0 111.79 -174.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.473 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.1 pt? -75.14 -35.91 61.63 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.793 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -50.66 -41.63 55.68 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.021 0.929 . . . . 0.0 112.733 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.433 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 93.7 m95 -80.67 -54.53 5.55 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.399 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -41.28 -46.63 3.26 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.4 ptm -61.52 -46.97 87.7 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -68.42 -36.58 79.28 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.489 0.661 . . . . 0.0 111.522 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 29.4 mmmt -67.05 -33.94 76.6 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.017 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 121.532 0.682 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 6.6 t -103.72 118.1 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 167.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.56 -22.81 66.73 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.047 0.385 . . . . 0.0 111.377 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mt -84.24 -41.73 16.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 122.78 0.432 . . . . 0.0 111.499 -172.403 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.7 p -136.92 -0.61 2.28 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.3 39.15 96.83 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 114.613 0.605 . . . . 0.0 114.613 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -64.49 -38.0 89.49 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.016 0.526 . . . . 0.0 111.212 -176.193 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 74.64 114.81 0.06 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.449 1.499 . . . . 0.0 110.014 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -122.19 163.63 19.23 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.302 0.641 . . . . 0.0 109.937 -179.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.99 -1.4 52.47 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -158.62 144.67 16.89 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.671 0.788 . . . . 0.0 108.919 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -58.22 -27.52 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.459 1.104 . . . . 0.0 110.937 174.542 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -54.54 -44.7 73.06 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.544 0.738 . . . . 0.0 110.813 173.891 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -70.24 -29.04 65.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.509 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.27 -45.35 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 123.972 0.909 . . . . 0.0 110.494 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 88.5 t -71.44 -37.6 65.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.341 1.056 . . . . 0.0 109.147 -176.497 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.63 78.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.847 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -72.13 -33.89 68.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.449 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -73.59 -33.28 64.54 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.349 0.595 . . . . 0.0 109.482 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.58 71.54 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.016 174.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -87.96 -58.77 2.45 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-O 121.473 0.654 . . . . 0.0 111.448 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.5 t -91.78 -8.18 47.48 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.878 1.271 . . . . 0.0 111.554 -167.705 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 CA--C 1.564 1.514 0 C-N-CA 123.112 0.565 . . . . 0.0 111.084 179.256 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -127.15 89.38 2.96 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -174.167 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 63.0 m-85 -93.09 113.75 26.09 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.197 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.77 HG22 ' H ' ' A' ' 17' ' ' GLU . 9.5 mm -119.69 158.67 21.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 124.562 1.145 . . . . 0.0 108.491 -170.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.63 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.9 t -104.39 -10.03 18.04 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.828 0.851 . . . . 0.0 110.572 176.948 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.77 ' H ' HG22 ' A' ' 15' ' ' ILE . 3.1 mp0 88.65 -16.49 0.3 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.745 2.018 . . . . 0.0 112.391 170.131 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -134.86 -51.54 0.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.319 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.9 p -122.67 74.2 1.18 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.698 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.63 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -164.13 146.23 8.99 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.58 0.705 . . . . 0.0 112.229 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -77.9 -171.26 2.2 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 113.831 -1.531 . . . . 0.0 108.979 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.61 125.24 30.96 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.476 ' HB3' ' HB2' ' A' ' 28' ' ' ASN . 67.9 m-85 -110.23 147.54 33.58 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.058 0.543 . . . . 0.0 110.654 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -58.62 -37.22 75.43 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.119 0.968 . . . . 0.0 112.38 175.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.6 t -147.59 156.05 42.42 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.061 0.458 . . . . 0.0 111.103 -167.814 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.2 p -57.02 -27.08 61.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.662 -1.153 . . . . 0.0 111.551 171.282 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 36.7 t60 -70.99 -41.04 71.49 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.945 0.498 . . . . 0.0 110.625 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 2.3 m-20 -60.75 -49.62 76.78 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.021 0.915 . . . . 0.0 110.209 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 tp -63.83 -35.56 81.02 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.45 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.95 -31.98 71.52 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 123.444 0.697 . . . . 0.0 112.443 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.502 HG13 ' HB ' ' A' ' 50' ' ' THR . 79.0 t -64.08 -49.4 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.658 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -60.07 -39.18 85.17 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.773 0.829 . . . . 0.0 110.913 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -67.13 2.09 1.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.07 1.348 . . . . 0.0 111.73 -175.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.9 ptp -44.97 -22.95 0.11 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.58 1.552 . . . . 0.0 113.482 172.897 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.11 -50.59 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.772 1.229 . . . . 0.0 110.042 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -98.26 6.44 47.4 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.162 0.585 . . . . 0.0 111.638 -171.421 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -58.84 -60.19 4.23 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -164.59 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.48 -32.19 0.99 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 122.929 0.3 . . . . 0.0 113.335 -168.899 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.17 -42.83 75.37 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.749 1.219 . . . . 0.0 110.16 171.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 68.4 100.76 0.04 OUTLIER Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.729 1.611 . . . . 0.0 111.091 -171.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.87 -162.81 0.11 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.815 2.343 . . . . 0.0 111.603 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 54' ' ' LYS . 43.7 mt -100.01 106.34 18.11 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.221 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -132.33 135.51 46.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.539 0.736 . . . . 0.0 110.236 -169.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 1.2 t -65.32 107.79 1.73 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.108 0.963 . . . . 0.0 110.805 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -87.96 56.38 3.85 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.899 0.857 . . . . 0.0 110.811 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mm -125.93 -54.35 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 164.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.5 p -119.37 -116.99 0.32 Allowed 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 176.359 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -146.15 164.07 28.33 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 155.016 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 8.1 t80 171.25 113.1 0.01 OUTLIER 'General case' 0 C--N 1.348 0.511 0 N-CA-C 101.794 -3.41 . . . . 0.0 101.794 -174.204 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.502 ' HB ' HG13 ' A' ' 31' ' ' VAL . 8.0 m -121.75 129.5 52.74 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -170.206 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.6 t -141.01 163.12 33.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.637 -175.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -76.47 -21.04 56.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.493 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -117.76 116.23 26.6 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.483 1.113 . . . . 0.0 109.636 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' LYS . . . . . 0.443 ' N ' HD13 ' A' ' 42' ' ' LEU . 63.4 tttm -57.61 -34.77 69.62 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.142 0.977 . . . . 0.0 111.801 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.65 70.97 Favored 'General case' 0 CA--C 1.554 1.122 0 O-C-N 123.846 0.716 . . . . 0.0 112.301 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -61.85 -55.27 31.63 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.745 0.418 . . . . 0.0 111.3 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -71.26 -27.93 63.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.133 0.573 . . . . 0.0 111.687 178.844 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -52.58 -44.12 65.72 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.721 0.808 . . . . 0.0 112.396 171.396 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -76.72 -45.83 27.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 63.8 t60 -45.94 -40.93 10.92 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 168.14 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 66.8 mtm -71.82 -37.4 70.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.384 -0.823 . . . . 0.0 112.624 174.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -56.89 -32.15 65.59 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 168.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -67.96 -42.39 81.0 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.4 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 29.1 m80 . . . . . 0 N--CA 1.49 1.566 0 C-N-CA 123.235 0.614 . . . . 0.0 111.389 171.541 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.5 p . . . . . 0 C--O 1.238 0.493 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.42 115.58 7.21 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -61.24 -19.25 61.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.182 0.593 . . . . 0.0 111.707 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 mt -96.12 -42.97 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.232 0 C-N-CA 123.62 0.768 . . . . 0.0 112.149 -175.432 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' CYS . . . . . 0.607 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.8 p -135.29 -5.11 2.33 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.44 1.018 . . . . 0.0 113.24 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.57 32.25 77.57 Favored Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.102 0.382 . . . . 0.0 113.873 176.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.607 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 52.9 tttm -69.89 -15.8 63.13 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -170.243 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt 76.13 112.68 0.07 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 124.52 1.128 . . . . 0.0 111.933 167.13 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -133.87 148.62 51.28 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.598 0.759 . . . . 0.0 111.847 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.57 -18.48 65.02 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.907 1.283 . . . . 0.0 113.821 -174.0 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.488 ' HG3' ' H ' ' A' ' 86' ' ' SER . 0.3 OUTLIER -144.84 148.31 33.85 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.851 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.46 -29.99 71.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.658 0.783 . . . . 0.0 110.288 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -56.6 -41.67 77.42 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.295 170.736 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.488 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 43.3 t -69.02 -30.42 68.79 Favored 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 122.951 0.5 . . . . 0.0 110.944 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.56 -44.49 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.737 0.815 . . . . 0.0 109.745 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -74.13 -36.35 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.141 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.22 -40.44 94.11 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.936 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.97 -29.64 66.8 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.765 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -72.09 -40.79 67.98 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.466 0.65 . . . . 0.0 109.77 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.0 63.08 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.637 178.202 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -98.78 -51.69 3.82 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.373 1.069 . . . . 0.0 112.029 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.3 t -92.85 -14.03 28.26 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.858 1.263 . . . . 0.0 111.405 -169.84 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.4 m-70 . . . . . 0 CA--C 1.556 1.199 0 C-N-CA 122.835 0.454 . . . . 0.0 110.956 179.927 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -125.92 83.92 2.22 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.514 -1.221 . . . . 0.0 107.909 -173.942 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -81.93 115.3 21.04 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.9 -1.5 . . . . 0.0 110.024 -175.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.418 HG22 ' H ' ' A' ' 17' ' ' GLU . 15.4 mm -105.31 137.49 34.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -175.527 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.654 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 43.5 t -80.93 -24.73 37.96 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.211 0.604 . . . . 0.0 110.256 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.418 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.4 tt0 117.5 -28.63 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 127.728 2.411 . . . . 0.0 110.541 167.05 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -133.06 -42.4 0.89 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.114 0.966 . . . . 0.0 108.587 -173.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 66.76 1.01 Allowed 'General case' 0 C--O 1.242 0.68 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.242 -178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.654 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.04 124.2 1.5 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.989 162.095 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -67.74 -52.73 34.01 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 169.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -178.05 132.11 0.15 Allowed 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.393 1.477 . . . . 0.0 108.575 163.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -100.17 135.2 41.96 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 170.996 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -73.79 -10.99 60.23 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.262 0.625 . . . . 0.0 111.375 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -146.91 134.99 21.54 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 122.751 0.42 . . . . 0.0 110.833 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.636 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.1 m -59.82 -34.82 73.57 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.432 1.093 . . . . 0.0 111.588 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -62.36 -44.81 95.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.045 0.938 . . . . 0.0 110.748 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -66.89 -42.53 85.35 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.739 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -62.68 -34.87 78.01 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.439 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.67 69.16 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 123.754 0.659 . . . . 0.0 111.985 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 52' ' ' ARG . 39.6 t -63.92 -47.76 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.74 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -62.87 -39.9 95.85 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.194 0.998 . . . . 0.0 110.534 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 41.8 ttt180 -68.62 5.94 0.95 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.41 1.084 . . . . 0.0 111.842 -173.231 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.6 ptp -42.87 -20.8 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 126.512 1.925 . . . . 0.0 114.853 176.313 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.32 -58.46 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 108.637 178.676 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.54 10.52 37.03 Favored 'General case' 0 N--CA 1.501 2.113 0 C-N-CA 124.458 1.103 . . . . 0.0 113.137 -170.345 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.415 ' OG1' ' HB2' ' A' ' 39' ' ' GLU . 4.5 t -57.8 -65.12 0.69 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -164.485 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.67 36.4 91.24 Favored Glycine 0 N--CA 1.476 1.357 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.415 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 37.1 mt-10 -149.86 -34.77 0.17 Allowed 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.902 1.681 . . . . 0.0 107.781 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt 46.77 75.93 0.61 Allowed Pre-proline 0 C--N 1.371 1.539 0 C-N-CA 126.263 1.825 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.36 -74.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.382 2.33 0 C-N-CA 123.107 2.538 . . . . 0.0 111.842 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 51' ' ' CYS . 95.4 mt -145.49 98.94 3.22 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.443 ' HG2' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -129.85 141.76 50.78 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -168.444 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.6 t -66.1 102.9 0.87 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLU . . . . . 0.422 ' CD ' ' H ' ' A' ' 45' ' ' GLU . 0.9 OUTLIER -73.97 -1.47 19.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.828 0.851 . . . . 0.0 111.945 177.969 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.515 HD11 ' SD ' ' A' ' 61' ' ' MET . 3.4 mp -83.8 -55.6 6.91 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 N-CA-C 107.103 -1.444 . . . . 0.0 107.103 174.551 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 18.3 p -132.58 -97.92 0.3 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.396 176.339 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.476 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -155.46 131.19 3.0 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 116.906 -2.052 . . . . 0.0 109.078 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.0 t80 164.83 113.56 0.01 OUTLIER 'General case' 0 C--N 1.354 0.804 0 N-CA-C 102.402 -3.184 . . . . 0.0 102.402 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 43' ' ' GLN . 3.1 m -128.42 126.51 40.72 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 96.4 m -150.45 141.74 23.25 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.442 -175.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 31' ' ' VAL . 29.9 ptt180 -69.66 -12.19 61.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.588 0.755 . . . . 0.0 111.147 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -101.02 107.76 19.3 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.35 -41.77 29.51 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.127 1.371 . . . . 0.0 111.65 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.87 -29.48 59.99 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.68 -1.145 . . . . 0.0 113.023 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.2 m -69.41 -56.34 7.74 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.134 -0.354 . . . . 0.0 111.816 179.354 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -75.68 -48.49 21.78 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.215 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -55.89 -31.38 62.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.446 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 27.2 m95 -83.98 -39.59 19.53 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.305 178.12 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -45.88 -37.86 6.76 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.515 ' SD ' HD11 ' A' ' 46' ' ' ILE . 23.0 ttp -62.61 -47.03 85.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.754 0.822 . . . . 0.0 111.252 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.75 -36.97 80.26 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.538 0.735 . . . . 0.0 111.24 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 64.2 mttm -62.58 -33.94 75.97 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.624 0.769 . . . . 0.0 111.255 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' HIS . . . . . 0.421 ' CD2' ' HA ' ' A' ' 61' ' ' MET . 3.1 p80 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--O 1.237 0.41 0 CA-C-O 121.101 0.477 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.2 t -89.12 118.81 29.11 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 105.944 -1.872 . . . . 0.0 105.944 168.401 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -66.41 -19.81 65.9 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-O 121.024 0.44 . . . . 0.0 111.501 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -88.15 -37.32 10.39 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.279 0 C-N-CA 123.029 0.532 . . . . 0.0 111.785 -173.574 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.3 p -150.33 17.07 0.83 Allowed 'General case' 0 C--N 1.377 1.778 0 CA-C-N 119.449 1.022 . . . . 0.0 113.393 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 49.35 46.48 35.81 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 117.286 1.675 . . . . 0.0 117.286 160.77 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.68 -45.1 88.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 117.313 0.557 . . . . 0.0 111.241 173.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 69.07 112.72 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.484 1.114 . . . . 0.0 109.447 -167.813 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -111.32 167.89 9.95 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.209 1.004 . . . . 0.0 110.625 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.29 -31.51 71.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.179 0.592 . . . . 0.0 112.473 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HG2' ' H ' ' A' ' 86' ' ' SER . 0.0 OUTLIER -139.7 155.59 47.28 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.068 0.461 . . . . 0.0 110.403 177.872 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -62.43 -31.14 71.8 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.305 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -59.28 -38.54 80.4 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.513 0.725 . . . . 0.0 110.592 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.411 ' H ' ' HG2' ' A' ' 83' ' ' LYS . 67.6 m -70.28 -29.63 66.44 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 122.764 0.426 . . . . 0.0 111.571 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.06 -43.8 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.422 0.689 . . . . 0.0 109.688 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 80.6 t -71.57 -38.26 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.955 1.302 . . . . 0.0 109.239 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.01 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.71 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -72.32 -40.91 67.13 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.479 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -70.69 -38.6 73.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.77 0.828 . . . . 0.0 109.362 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.62 -28.81 68.05 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.451 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -91.62 -45.07 8.67 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.872 0.869 . . . . 0.0 111.207 -173.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.5 t -94.08 -23.35 18.01 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.746 1.219 . . . . 0.0 111.191 -169.507 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 . . . . . 0 CA--C 1.569 1.677 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -176.388 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.66 80.98 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -169.267 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -81.97 104.23 12.18 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.842 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -113.38 157.59 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 124.286 1.034 . . . . 0.0 109.777 -171.046 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.9 t -119.75 37.15 4.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.267 1.427 . . . . 0.0 108.149 -173.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 53.17 -37.46 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 127.827 2.451 . . . . 0.0 117.144 -172.968 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -133.86 -48.84 0.81 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.899 0.88 . . . . 0.0 110.629 -167.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -113.5 29.98 7.58 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.954 -168.194 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.29 142.11 46.22 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.89 0.852 . . . . 0.0 111.825 167.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 21' ' ' ARG . 13.9 ptp180 -72.54 -114.53 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 113.363 -1.744 . . . . 0.0 108.178 164.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -137.2 124.41 21.75 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 161.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -109.1 136.6 48.33 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -87.98 0.71 55.57 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 t -146.26 140.4 26.48 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 122.885 0.474 . . . . 0.0 110.126 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.0 m -46.09 -56.77 5.16 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.361 1.465 . . . . 0.0 113.266 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 31' ' ' VAL . 93.5 m-70 -69.34 -33.54 73.26 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.677 0.791 . . . . 0.0 111.776 -175.286 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -51.32 -55.37 18.73 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.063 0.945 . . . . 0.0 111.446 175.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.38 -45.7 87.79 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 114.889 -1.05 . . . . 0.0 112.187 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.66 -27.52 50.37 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.606 0.763 . . . . 0.0 112.785 178.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 27' ' ' HIS . 63.1 t -64.98 -51.14 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.358 0.663 . . . . 0.0 110.417 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -61.57 -40.11 93.55 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.382 0.673 . . . . 0.0 109.831 175.592 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 39.4 ttt180 -67.26 4.71 0.88 Allowed 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.622 -176.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -45.46 -17.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 125.708 1.603 . . . . 0.0 114.957 174.156 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.99 -59.69 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.43 0 C-N-CA 125.128 1.371 . . . . 0.0 109.213 176.233 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.05 9.35 40.43 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.132 0.973 . . . . 0.0 112.98 -171.065 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.5 t -58.53 -56.39 22.7 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.89 0.876 . . . . 0.0 113.247 -170.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.18 -32.07 3.08 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 119.835 -0.425 . . . . 0.0 112.544 -170.116 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.13 -37.27 69.49 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 123.729 0.812 . . . . 0.0 111.306 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 68.02 110.35 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.927 1.291 . . . . 0.0 111.599 -170.999 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.84 -164.65 0.28 Allowed 'Trans proline' 0 C--N 1.383 2.354 0 C-N-CA 122.551 2.167 . . . . 0.0 110.352 165.415 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.6 mt -117.12 104.25 11.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.233 0.613 . . . . 0.0 109.48 -177.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 24.3 tm0? -127.25 141.39 51.74 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.682 0.793 . . . . 0.0 109.077 -168.095 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 t -69.49 107.98 3.59 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.612 0.765 . . . . 0.0 111.648 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -55.93 -27.54 52.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.73 1.212 . . . . 0.0 113.312 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.18 -57.51 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 122.736 0.414 . . . . 0.0 109.919 -174.84 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.5 p -129.45 -88.44 0.51 Allowed 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -154.08 145.9 13.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 116.997 -2.002 . . . . 0.0 108.781 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' GLN . 20.1 t80 165.5 110.91 0.01 OUTLIER 'General case' 0 C--N 1.358 0.954 0 N-CA-C 102.302 -3.221 . . . . 0.0 102.302 166.988 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -118.85 136.3 54.1 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -174.536 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.526 ' SG ' HD22 ' A' ' 57' ' ' LEU . 25.7 p -157.33 -173.99 4.68 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.759 -176.513 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.75 13.38 7.43 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.739 0.815 . . . . 0.0 109.029 172.215 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -121.63 104.94 9.99 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.652 1.181 . . . . 0.0 108.303 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -55.97 -31.78 63.31 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.439 1.096 . . . . 0.0 112.918 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.03 -43.08 91.58 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.49 1.119 . . . . 0.0 111.903 174.503 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -61.25 -55.89 26.87 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.452 0.701 . . . . 0.0 112.187 -171.334 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.526 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -75.4 -27.37 59.03 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.576 178.053 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -50.21 -44.97 53.4 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -80.79 -37.77 29.66 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 122.358 -0.214 . . . . 0.0 110.596 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 63' ' ' LYS . 83.1 t60 -48.5 -43.12 34.77 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.9 ptm -72.66 -33.84 66.84 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 119.218 0.917 . . . . 0.0 112.285 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -28.01 64.61 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.403 0.681 . . . . 0.0 111.183 168.1 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 60' ' ' HIS . 28.6 mtpp -72.39 -36.79 68.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.451 0.7 . . . . 0.0 110.364 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 . . . . . 0 N--CA 1.491 1.598 0 C-N-CA 123.507 0.723 . . . . 0.0 111.437 177.026 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.5 p . . . . . 0 C--O 1.237 0.419 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.51 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 6.2 t -67.39 122.91 18.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 169.518 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -53.51 -26.86 22.6 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.8 mt -109.42 -25.94 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.566 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -171.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 p -140.37 5.23 2.04 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-N 120.474 1.488 . . . . 0.0 113.258 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 51.88 42.86 54.27 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 114.695 0.638 . . . . 0.0 114.695 174.073 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.51 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 3.8 tmtp? -65.51 -39.01 91.34 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -176.093 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.58 122.59 0.05 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 125.065 1.346 . . . . 0.0 111.408 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.5 m-85 -135.68 148.62 48.99 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.123 1.369 . . . . 0.0 108.444 176.548 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.8 -19.27 65.71 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -174.329 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.35 140.7 47.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 124.418 1.087 . . . . 0.0 108.14 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -58.88 -27.85 65.58 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.266 1.026 . . . . 0.0 110.653 175.443 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -56.88 -47.14 81.14 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.346 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.7 m -67.43 -27.68 67.26 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 122.431 0.292 . . . . 0.0 111.702 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t -71.22 -44.5 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.425 0.69 . . . . 0.0 110.098 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 79.5 t -73.78 -38.18 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.846 1.258 . . . . 0.0 109.592 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.01 96.23 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.521 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -73.32 -38.56 65.76 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.073 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -72.57 -37.71 68.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.963 0.505 . . . . 0.0 110.947 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.74 -30.39 69.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.103 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -90.15 -46.31 8.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.835 0.854 . . . . 0.0 111.643 -171.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 42.4 t -88.16 -19.04 27.48 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.463 1.105 . . . . 0.0 110.652 -172.785 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 . . . . . 0 CA--C 1.557 1.225 0 C-N-CA 123.649 0.78 . . . . 0.0 109.246 -176.615 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.508 ' HA ' ' HB1' ' A' ' 22' ' ' ALA . 15.8 m-20 -121.99 86.09 2.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.52 -162.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -93.64 111.6 23.31 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.498 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.7 mm -108.35 145.67 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.558 -167.28 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.607 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 39.2 t -98.64 44.29 1.04 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 55.86 -40.53 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.226 2.61 . . . . 0.0 115.822 -172.373 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -134.94 -43.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.991 1.316 . . . . 0.0 109.414 -165.283 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -117.69 53.61 0.93 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.696 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.607 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -154.22 127.49 8.46 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.992 158.444 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -58.44 3.94 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 171.737 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.508 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -170.47 127.37 0.79 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.38 0.672 . . . . 0.0 110.867 164.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.66 157.72 16.75 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.443 0.697 . . . . 0.0 109.13 171.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -59.59 -36.08 75.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.156 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.2 m -145.75 155.85 43.22 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.223 0.535 . . . . 0.0 111.068 -176.106 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 p -59.03 -34.51 71.99 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.979 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -73.74 -33.16 64.21 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.269 0.628 . . . . 0.0 110.601 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.15 -50.94 69.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.278 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.403 HD13 ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -63.49 -33.14 74.92 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.374 0.67 . . . . 0.0 111.406 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.467 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -53.75 -27.51 28.99 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.425 1.078 . . . . 0.0 112.198 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 89.6 t -64.61 -48.06 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.864 0.865 . . . . 0.0 111.347 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.88 -37.84 82.28 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.623 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 52.4 ttt85 -62.64 -3.43 1.49 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.718 1.607 . . . . 0.0 112.615 -177.436 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 20.8 ptt? -45.06 -16.19 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.4 tp -85.51 -51.3 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 C-N-CA 125.358 1.463 . . . . 0.0 110.027 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -104.6 11.71 33.9 Favored 'General case' 0 N--CA 1.508 2.472 0 C-N-CA 125.158 1.383 . . . . 0.0 112.996 -178.311 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.623 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 7.1 t -57.95 -55.05 39.88 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -161.193 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.05 36.69 91.08 Favored Glycine 0 N--CA 1.473 1.164 0 N-CA-C 112.025 -0.43 . . . . 0.0 112.025 -171.982 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 33.7 mt-10 -158.82 -58.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -168.641 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 76.58 97.45 0.04 OUTLIER Pre-proline 0 C--N 1.352 0.708 0 C-N-CA 126.824 2.05 . . . . 0.0 111.504 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.33 172.16 12.71 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 122.508 2.139 . . . . 0.0 110.915 164.481 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -89.34 138.51 31.37 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -139.39 136.79 35.08 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.242 0.339 . . . . 0.0 110.277 -171.389 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.548 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 3.9 t -70.56 106.39 3.45 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.875 0.87 . . . . 0.0 109.433 175.85 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.33 16.65 1.23 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.834 0.854 . . . . 0.0 112.646 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.548 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 3.5 mp -94.53 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.351 0.656 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.515 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 23.7 p -116.32 -108.38 0.37 Allowed 'General case' 0 C--O 1.24 0.571 0 N-CA-C 104.206 -2.516 . . . . 0.0 104.206 172.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.515 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.09 159.85 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 108.593 -1.803 . . . . 0.0 108.593 155.773 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 15.4 t80 174.08 111.16 0.02 OUTLIER 'General case' 0 C--N 1.353 0.737 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.0 m -119.73 135.25 54.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -171.54 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.8 t -157.31 157.96 35.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.728 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.476 ' HD2' ' N ' ' A' ' 53' ' ' GLN . 2.2 ppt_? -78.47 -21.82 48.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.526 -1.215 . . . . 0.0 111.677 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.476 ' N ' ' HD2' ' A' ' 52' ' ' ARG . 8.0 tp60 -98.62 115.84 29.52 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -174.87 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.22 -34.27 63.8 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 176.535 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.98 -41.43 71.19 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 124.266 0.979 . . . . 0.0 111.85 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.2 m -57.42 -56.48 21.31 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.274 0.63 . . . . 0.0 112.174 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.568 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -76.29 -27.62 56.7 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.048 0.539 . . . . 0.0 111.969 177.763 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -50.4 -46.79 56.47 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 123.616 0.766 . . . . 0.0 112.59 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -81.02 -46.06 15.62 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.542 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 78.6 t60 -45.53 -43.09 11.59 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.6 ptm -63.1 -39.76 95.64 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 118.667 0.667 . . . . 0.0 111.459 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.86 -24.92 64.4 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 122.827 0.451 . . . . 0.0 111.625 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.3 -29.95 71.18 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.5 0.32 . . . . 0.0 110.693 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 N--CA 1.494 1.746 0 C-N-CA 124.083 0.953 . . . . 0.0 112.106 178.018 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.414 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 36.2 t -96.68 124.09 40.56 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 162.601 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ASN . . . . . 0.406 ' OD1' HG13 ' A' ' 76' ' ' ILE . 14.7 p30 -62.45 -20.42 64.52 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 76' ' ' ILE . . . . . 0.406 HG13 ' OD1' ' A' ' 75' ' ' ASN . 7.2 mt -104.11 -37.05 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.912 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.8 p -134.62 13.09 3.74 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 119.62 1.1 . . . . 0.0 113.007 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 50.36 32.83 23.04 Favored Glycine 0 C--N 1.358 1.753 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 171.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.414 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 8.3 tmtm? -63.69 -35.17 79.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.889 0.876 . . . . 0.0 112.57 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? 75.09 115.61 0.06 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.384 1.074 . . . . 0.0 109.948 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 96.2 m-85 -124.22 154.6 39.92 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.769 0.827 . . . . 0.0 111.475 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.43 -41.26 98.58 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.434 1.094 . . . . 0.0 111.354 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.549 ' HB2' ' H ' ' A' ' 86' ' ' SER . 35.4 mtpt -121.61 144.59 48.66 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 123.823 0.849 . . . . 0.0 108.747 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 84' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 88' ' ' VAL . 52.3 mtmt -65.03 -31.21 72.33 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.091 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 85' ' ' ASP . . . . . 0.424 ' HB3' ' HE2' ' A' ' 83' ' ' LYS . 33.1 t70 -54.61 -46.0 73.76 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.387 1.075 . . . . 0.0 110.578 170.047 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.549 ' H ' ' HB2' ' A' ' 83' ' ' LYS . 19.7 m -62.53 -32.44 73.38 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 123.336 0.397 . . . . 0.0 111.993 176.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 45.2 t -74.62 -45.03 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.128 0.571 . . . . 0.0 110.113 -175.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 88' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 84' ' ' LYS . 99.3 t -70.92 -37.69 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.45 1.1 . . . . 0.0 109.29 -175.099 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.14 -38.43 82.16 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.673 -1.148 . . . . 0.0 109.511 177.302 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -73.06 -33.83 65.89 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.603 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -73.69 -45.75 50.45 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.199 0.599 . . . . 0.0 110.35 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.11 -21.0 66.33 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.672 0.789 . . . . 0.0 111.825 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -100.28 -49.96 4.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.995 0.918 . . . . 0.0 111.982 -175.217 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 28.6 t -99.81 -4.35 30.7 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.189 0.996 . . . . 0.0 111.427 -168.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 . . . . . 0 CA--C 1.568 1.651 0 C-N-CA 124.05 0.94 . . . . 0.0 110.804 179.681 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 122.219 1.009 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ASP . . . . . 0.502 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 4.7 m-20 -134.72 93.72 3.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.704 1.202 . . . . 0.0 108.362 -167.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -79.36 113.59 17.62 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.244 1.418 . . . . 0.0 109.948 177.406 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.8 mt -109.6 134.04 52.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 C-N-CA 123.585 0.754 . . . . 0.0 110.338 -175.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 9.9 t -80.16 103.01 9.74 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 159.813 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.97 -15.01 7.47 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.613 1.165 . . . . 0.0 112.834 -168.16 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.93 -40.16 5.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.005 0.522 . . . . 0.0 110.485 -171.385 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -141.8 48.84 1.6 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.356 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ALA . . . . . 0.485 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -155.54 148.28 24.21 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 163.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' ARG . . . . . 0.415 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 10.5 ptp180 -71.86 -72.49 0.22 Allowed 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.785 168.894 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ALA . . . . . 0.502 ' HB1' ' HB3' ' A' ' 13' ' ' ASP . . . -171.15 154.63 4.1 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.234 1.013 . . . . 0.0 109.696 172.046 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -131.72 143.14 50.05 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.523 0.729 . . . . 0.0 109.335 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.17 -7.67 50.44 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.463 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.7 m -149.9 152.85 35.7 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.231 0.612 . . . . 0.0 110.395 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.0 t -61.5 -34.39 75.43 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.7 0.8 . . . . 0.0 111.726 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -73.28 -37.62 66.19 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.766 0.426 . . . . 0.0 110.788 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.59 -46.99 80.52 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.953 0.883 . . . . 0.0 109.927 173.666 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 tp -62.43 -39.12 92.27 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.592 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -54.33 -28.31 41.79 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.704 0.802 . . . . 0.0 112.496 176.529 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.0 t -63.73 -43.73 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.11 0.964 . . . . 0.0 111.185 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -70.5 -44.46 67.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.685 0.755 . . . . 0.0 110.391 170.339 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.571 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 49.7 ttp180 -70.87 4.43 2.58 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.059 -171.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' MET . . . . . 0.422 ' O ' HG21 ' A' ' 50' ' ' THR . 19.8 ptt? -44.82 -20.4 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.184 1.394 . . . . 0.0 114.079 170.976 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -47.13 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 125.434 1.494 . . . . 0.0 109.346 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -101.19 -11.34 19.61 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -172.94 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 33' ' ' ARG . 4.5 t -60.1 -41.88 93.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -152.277 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.8 39.6 89.87 Favored Glycine 0 C--N 1.347 1.17 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.646 -178.604 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.6 -80.74 0.52 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -171.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 164.05 93.54 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.336 1.854 . . . . 0.0 109.231 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -97.13 -155.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 124.044 3.162 . . . . 0.0 111.08 173.599 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.3 mt -93.28 83.25 4.58 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -118.97 136.06 54.29 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.745 -171.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.723 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 8.3 t -68.95 106.72 2.84 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.166 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -93.6 53.43 1.86 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.645 1.212 . . . . 0.0 108.056 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.723 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -134.28 -7.14 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 125.938 1.695 . . . . 0.0 108.978 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 13.1 p -178.68 -118.09 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 103.733 -2.691 . . . . 0.0 103.733 -168.158 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.69 134.68 4.84 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 161.347 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.8 t80 178.1 117.99 0.04 OUTLIER 'General case' 0 C--N 1.351 0.653 0 N-CA-C 102.481 -3.155 . . . . 0.0 102.481 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 34' ' ' MET . 6.8 m -124.57 147.4 48.47 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.213 0.915 . . . . 0.0 110.141 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.532 ' SG ' HD22 ' A' ' 57' ' ' LEU . 16.2 p -148.9 179.14 8.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.016 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.35 23.4 6.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.135 1.374 . . . . 0.0 108.142 177.293 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -146.52 118.2 8.07 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.298 -167.087 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 -47.22 71.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.494 1.118 . . . . 0.0 113.094 -175.675 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.36 -33.25 70.94 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.0 m -63.65 -55.42 23.69 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.532 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -76.72 -26.35 54.55 Favored 'General case' 0 C--N 1.357 0.9 0 CA-C-N 118.09 0.405 . . . . 0.0 111.33 176.812 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.58 -49.61 72.28 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 173.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -79.19 -33.38 43.93 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.517 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 85.9 t60 -54.79 -38.51 67.39 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 167.096 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -31.25 62.57 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 120.127 1.33 . . . . 0.0 110.268 174.198 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -61.21 -27.78 68.68 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.411 0.684 . . . . 0.0 111.709 167.538 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 6.4 mmpt? -63.3 -44.64 94.44 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 123.155 0.582 . . . . 0.0 110.864 169.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 N--CA 1.491 1.599 0 C-N-CA 123.306 0.643 . . . . 0.0 111.107 172.112 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 74' ' ' CYS . . . . . 0.451 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 17.5 t -72.61 122.35 21.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 165.442 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -57.5 -27.04 62.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.186 0.994 . . . . 0.0 112.33 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.1 mt -94.84 -51.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.558 -174.925 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.0 p -128.82 11.24 6.1 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 119.455 1.025 . . . . 0.0 112.724 -172.494 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.81 41.69 28.07 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 114.68 0.632 . . . . 0.0 114.68 172.019 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.451 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 6.4 tmtm? -66.02 -41.83 90.46 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -177.718 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.4 mptt 72.77 121.57 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.85 1.26 . . . . 0.0 110.771 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -126.39 162.75 24.83 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.242 1.017 . . . . 0.0 111.378 -178.448 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -69.19 -18.73 63.95 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HG3' ' H ' ' A' ' 86' ' ' SER . 26.0 pttm -147.32 148.63 31.58 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.44 -25.22 67.91 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.326 0.65 . . . . 0.0 110.759 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -61.29 -38.11 85.64 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.349 0.66 . . . . 0.0 110.76 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.447 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 70.8 m -68.98 -30.0 68.33 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.83 0.452 . . . . 0.0 111.1 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 93.7 t -72.39 -44.32 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 C-N-CA 123.475 0.71 . . . . 0.0 109.999 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 68.1 t -72.27 -37.86 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.295 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.08 -37.3 85.46 Favored 'General case' 0 C--N 1.35 0.601 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.615 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -71.7 -31.63 66.96 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.068 0.947 . . . . 0.0 111.245 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -71.47 -37.66 71.32 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.58 0.705 . . . . 0.0 109.103 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.62 -27.47 61.29 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.548 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -88.38 -52.36 5.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.066 0.946 . . . . 0.0 111.183 -174.722 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.9 t -97.32 -16.49 20.26 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.053 0.941 . . . . 0.0 110.983 -167.282 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 . . . . . 0 CA--C 1.571 1.771 0 CA-C-O 118.029 -0.986 . . . . 0.0 113.038 -177.878 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 121.746 0.784 . . . . 0.0 108.949 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -132.38 84.28 2.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -170.986 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.96 118.0 31.73 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 124.989 1.315 . . . . 0.0 109.074 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ILE . . . . . 0.555 HG22 ' H ' ' A' ' 17' ' ' GLU . 14.7 mm -125.29 156.61 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -169.249 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' CYS . . . . . 0.499 ' HB2' HD11 ' A' ' 29' ' ' LEU . 28.5 t -91.31 12.37 20.61 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.867 0.867 . . . . 0.0 110.285 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.555 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.8 mp0 88.21 -38.22 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.9 2.08 . . . . 0.0 110.705 169.411 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -139.17 -52.94 0.56 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.379 0.609 . . . . 0.0 109.993 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.8 p -98.52 70.5 1.96 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.218 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -148.97 -172.63 4.16 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 163.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -112.57 -104.5 0.39 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 175.163 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.76 134.05 22.99 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 161.941 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -118.26 165.33 13.96 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.572 0.749 . . . . 0.0 109.576 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -103.06 10.33 38.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.747 0.819 . . . . 0.0 111.045 177.405 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -169.01 139.74 2.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.056 0.943 . . . . 0.0 109.936 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.8 p -73.61 -37.47 65.39 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.182 0.993 . . . . 0.0 110.956 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.35 -35.13 73.37 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.526 177.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' VAL . 55.6 t30 -59.12 -54.18 49.9 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.456 0.646 . . . . 0.0 109.97 170.563 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -54.66 -30.05 54.2 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.46 1.504 . . . . 0.0 112.439 178.239 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.71 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -52.71 -24.29 8.37 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.455 HG22 ' O ' ' A' ' 28' ' ' ASN . 32.5 m -53.47 -49.12 56.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 170.929 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -74.94 -46.8 33.19 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.594 0.711 . . . . 0.0 109.273 172.533 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' ARG . . . . . 0.71 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 19.2 ttt180 -76.82 41.87 0.29 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.615 1.566 . . . . 0.0 109.428 -173.543 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -66.79 -57.26 7.42 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.188 -163.302 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.4 tp -68.27 -26.98 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 168.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 17.0 m80 -79.45 -34.86 41.17 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.094 1.77 . . . . 0.0 108.736 -158.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t -70.55 -36.58 73.74 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.268 -166.82 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.04 -30.71 9.84 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.734 -0.481 . . . . 0.0 112.339 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -46.38 -39.07 9.79 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.812 1.245 . . . . 0.0 114.027 170.518 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 58.39 87.37 0.14 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.549 1.14 . . . . 0.0 111.535 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.46 -179.48 4.12 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.097 1.865 . . . . 0.0 111.276 166.887 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.7 mt -111.92 130.72 55.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -111.93 138.03 49.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.174 0.59 . . . . 0.0 109.952 -174.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.447 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 3.5 t -63.31 116.9 5.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.05 0.94 . . . . 0.0 110.231 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.08 33.04 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.945 1.298 . . . . 0.0 112.356 -171.911 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.9 mm -133.66 -7.0 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 125.074 1.349 . . . . 0.0 108.679 -172.578 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.536 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 0.8 OUTLIER 174.05 -139.39 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 -160.593 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.536 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -143.46 135.9 6.65 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 108.22 -1.952 . . . . 0.0 108.22 172.162 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 31.5 t80 179.12 115.23 0.04 OUTLIER 'General case' 0 C--N 1.348 0.54 0 N-CA-C 102.614 -3.106 . . . . 0.0 102.614 -172.27 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.65 130.29 56.81 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 122.765 0.426 . . . . 0.0 110.255 -166.828 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' CYS . . . . . 0.637 ' SG ' ' HB2' ' A' ' 56' ' ' SER . 42.8 t -149.03 151.63 34.86 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.281 -179.245 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -80.49 -30.34 37.37 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.94 0.896 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -92.5 111.32 22.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.323 1.049 . . . . 0.0 109.12 -176.273 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -53.7 -35.22 60.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.59 1.156 . . . . 0.0 112.891 -175.377 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.01 -48.69 77.73 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 123.965 0.791 . . . . 0.0 111.634 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' SER . . . . . 0.637 ' HB2' ' SG ' ' A' ' 51' ' ' CYS . 46.4 m -52.07 -50.96 60.51 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -173.454 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.468 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.7 OUTLIER -72.18 -33.62 67.81 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 119.366 -0.35 . . . . 0.0 111.112 177.734 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -57.4 -38.38 74.2 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.853 0.861 . . . . 0.0 111.849 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 72.4 m95 -78.86 -27.42 44.11 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.549 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 16.3 t60 -77.25 -30.06 54.29 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.784 0.833 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' MET . . . . . 0.447 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 94.9 mtp -69.05 -38.69 79.26 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.849 0.46 . . . . 0.0 110.426 176.719 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -64.59 -28.48 69.66 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.175 176.036 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.549 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 28.9 mmmt -55.96 -36.54 67.93 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.544 0.338 . . . . 0.0 111.371 170.285 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 53.4 m80 . . . . . 0 N--CA 1.495 1.825 0 C-N-CA 123.08 0.552 . . . . 0.0 111.539 176.658 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.4 p . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.0 120.98 13.04 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.864 0.866 . . . . 0.0 109.417 172.067 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -57.39 -27.76 62.63 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.34 0.656 . . . . 0.0 112.077 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.1 mt -93.63 -39.35 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -172.797 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.5 p -135.1 -1.56 2.63 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.83 1.196 . . . . 0.0 113.095 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 58.27 34.19 73.2 Favored Glycine 0 C--N 1.364 2.096 0 N-CA-C 114.624 0.61 . . . . 0.0 114.624 172.016 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 81' ' ' PHE . 9.2 tmtt? -63.92 -39.57 94.48 Favored 'General case' 0 CA--C 1.56 1.349 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -173.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' LYS . 4.9 mptp? 80.55 119.74 0.05 Allowed 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 124.914 1.285 . . . . 0.0 110.534 -174.717 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 79.2 m-85 -133.13 149.06 52.12 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.623 1.169 . . . . 0.0 108.648 176.017 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -9.1 9.34 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -174.044 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HG3' ' H ' ' A' ' 86' ' ' SER . 24.2 pttm -151.52 147.17 26.5 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 173.013 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.42 -28.42 68.26 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.063 0.945 . . . . 0.0 110.689 176.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.69 -42.21 74.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.621 0.769 . . . . 0.0 111.462 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' SER . . . . . 0.462 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 75.4 m -71.11 -29.05 64.78 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.202 0.314 . . . . 0.0 111.156 176.324 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.3 t -72.55 -44.97 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.834 0.854 . . . . 0.0 110.06 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 87.3 t -72.73 -39.46 60.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 C-N-CA 124.73 1.212 . . . . 0.0 109.447 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.35 -37.33 85.1 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.609 177.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -71.92 -32.2 67.13 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.723 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -71.95 -38.75 69.74 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 109.583 -178.007 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.56 -17.77 59.95 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.024 177.574 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -97.65 -45.65 6.3 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.459 0.704 . . . . 0.0 111.591 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 45.2 t -100.42 -14.93 18.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.712 1.205 . . . . 0.0 111.409 -168.761 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 . . . . . 0 CA--C 1.565 1.538 0 C-N-CA 123.826 0.85 . . . . 0.0 109.975 177.769 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 122.367 1.079 . . . . 0.0 108.132 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -120.75 80.99 1.7 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.423 -1.262 . . . . 0.0 107.89 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -78.84 118.38 20.82 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 113.393 -1.731 . . . . 0.0 109.501 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.2 mm -104.02 112.61 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.755 -171.249 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.5 t -59.99 101.43 0.12 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 161.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 31.48 -64.66 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 128.32 2.648 . . . . 0.0 115.592 160.659 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -125.04 -40.88 2.13 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.009 -166.48 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.16 -46.21 9.97 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.953 -163.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.82 127.16 31.42 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.163 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -68.74 -62.38 1.41 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.105 161.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.25 126.89 1.18 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.295 0.638 . . . . 0.0 110.833 164.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -98.71 144.72 27.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.533 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -71.88 -19.28 61.97 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -143.66 144.3 31.82 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.586 0.754 . . . . 0.0 110.055 -175.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' SER . . . . . 0.424 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.3 p -58.0 -32.98 68.44 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.853 0.861 . . . . 0.0 111.113 168.908 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' HIS . . . . . 0.457 ' O ' HG23 ' A' ' 31' ' ' VAL . 24.4 m-70 -68.03 -38.24 82.29 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.545 0.738 . . . . 0.0 109.994 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -49.45 75.24 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.136 0.974 . . . . 0.0 110.344 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.5 OUTLIER -60.69 -36.59 79.15 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.322 178.368 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.49 -30.88 71.93 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.534 1.146 . . . . 0.0 112.284 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 27' ' ' HIS . 48.3 t -66.45 -45.37 89.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.146 0.578 . . . . 0.0 110.443 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -33.66 68.47 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.524 0.729 . . . . 0.0 109.903 177.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.6 ttt180 -63.05 -2.55 1.3 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.619 1.168 . . . . 0.0 112.226 -176.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.9 ptm -45.93 -11.6 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 126.241 1.817 . . . . 0.0 114.612 173.574 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -83.75 -60.96 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.581 2.159 0 C-N-CA 124.934 1.294 . . . . 0.0 109.673 168.708 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.24 9.85 37.96 Favored 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -172.538 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -61.81 -56.59 17.8 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -167.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.19 -32.65 3.77 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 123.353 0.501 . . . . 0.0 112.388 -167.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -70.68 -46.56 62.96 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.706 0.802 . . . . 0.0 111.614 176.215 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt 70.7 94.96 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 125.26 1.424 . . . . 0.0 110.934 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.14 -177.4 2.3 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.512 2.141 . . . . 0.0 111.069 174.049 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -110.38 109.26 19.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.254 0.622 . . . . 0.0 109.534 -170.643 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.28 146.29 39.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.626 0.77 . . . . 0.0 109.248 -178.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 4.3 t -64.35 108.49 1.63 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.635 0.774 . . . . 0.0 110.177 171.83 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -67.37 4.78 0.9 Allowed 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 36.6 mm -95.23 -54.73 6.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.441 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' CYS . . . . . 0.538 ' HG ' ' H ' ' A' ' 48' ' ' GLY . 19.6 p -120.47 -110.94 0.34 Allowed 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 48' ' ' GLY . . . . . 0.538 ' H ' ' HG ' ' A' ' 47' ' ' CYS . . . -147.23 164.33 28.66 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 108.798 -1.721 . . . . 0.0 108.798 156.705 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.4 t80 171.24 110.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 102.449 -3.167 . . . . 0.0 102.449 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.65 132.44 56.68 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.79 0.805 . . . . 0.0 109.446 -164.396 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.1 t -152.54 166.19 32.79 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.317 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -100.37 -6.74 25.3 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.071 0.549 . . . . 0.0 110.37 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -113.21 112.3 23.53 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.396 1.078 . . . . 0.0 109.249 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -51.95 -38.01 54.97 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.691 0.797 . . . . 0.0 112.537 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.06 83.08 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.979 0.799 . . . . 0.0 112.364 -178.337 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -59.28 -54.98 40.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.293 0.637 . . . . 0.0 111.395 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LEU . . . . . 0.504 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.6 OUTLIER -76.58 -29.5 56.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.057 0.543 . . . . 0.0 112.183 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.82 -37.18 63.31 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.583 0.753 . . . . 0.0 112.781 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' TRP . . . . . 0.445 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 95.7 m95 -80.55 -47.34 14.34 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.281 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 72.7 t60 -45.45 -42.49 10.55 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.565 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 26.0 ptm -67.2 -38.74 85.85 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 118.524 0.602 . . . . 0.0 112.4 174.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -63.33 -30.47 71.6 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.309 0.644 . . . . 0.0 111.3 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 95.4 mttt -66.6 -28.6 68.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.258 0.623 . . . . 0.0 111.253 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 33.5 m80 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 123.395 0.678 . . . . 0.0 111.166 174.824 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.327 0.584 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.5 t -97.71 116.26 29.59 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 167.478 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -64.96 -19.54 66.02 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.307 0.503 . . . . 0.0 111.763 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.62 -40.03 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.233 0.613 . . . . 0.0 111.683 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -141.08 -0.88 1.42 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.54 40.65 98.08 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 114.444 0.538 . . . . 0.0 114.444 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 5.9 tmtt? -66.36 -28.98 69.07 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 123.401 0.68 . . . . 0.0 112.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt 71.42 110.53 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 125.316 1.446 . . . . 0.0 111.037 172.637 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' PHE . . . . . 0.415 ' CE2' ' HB3' ' A' ' 79' ' ' LYS . 97.1 m-85 -120.38 164.64 16.05 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -172.027 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -67.99 -35.55 78.53 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 114.649 -1.159 . . . . 0.0 113.027 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.87 170.54 19.57 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 117.93 0.332 . . . . 0.0 111.633 175.704 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -57.47 -40.0 77.6 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.839 1.255 . . . . 0.0 110.913 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.35 -44.47 72.19 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 123.571 0.545 . . . . 0.0 111.228 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.5 m -63.78 -34.84 78.81 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.513 0.508 . . . . 0.0 111.742 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.79 -41.49 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.424 0.69 . . . . 0.0 110.251 -175.099 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 89.1 t -72.42 -38.6 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.877 1.271 . . . . 0.0 109.038 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.2 96.67 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.139 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -71.9 -31.56 66.53 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.952 -178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.88 -45.23 62.04 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.21 -33.19 74.09 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.013 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -92.38 -47.63 7.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.533 0.733 . . . . 0.0 111.528 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.94 -7.46 21.47 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.616 0.766 . . . . 0.0 111.918 -168.728 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 . . . . . 0 CA--C 1.567 1.632 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 177.609 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.6 m80 . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 74.7 mtm -138.67 -55.16 0.62 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.959 0.904 . . . . 0.0 109.131 171.758 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -102.31 30.8 4.34 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.791 0.805 . . . . 0.0 109.429 176.234 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -121.09 81.24 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-N 114.7 -1.137 . . . . 0.0 108.521 -173.021 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -78.64 110.23 13.57 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.962 -174.457 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.7 mm -109.19 131.78 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.774 0.83 . . . . 0.0 109.179 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.817 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 36.2 t -90.13 52.81 2.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.394 1.077 . . . . 0.0 109.025 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 56.76 -53.12 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 126.988 2.115 . . . . 0.0 115.48 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -134.44 -45.23 0.76 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.017 1.327 . . . . 0.0 109.817 -166.692 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.5 p -107.2 37.39 2.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.529 -167.899 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -142.68 122.93 13.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.193 0.597 . . . . 0.0 109.416 160.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -67.13 -55.65 13.3 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.413 1.071 . . . . 0.0 109.996 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.55 130.06 0.55 Allowed 'General case' 0 C--N 1.355 0.831 0 C-N-CA 124.036 0.934 . . . . 0.0 109.621 161.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -110.48 154.9 23.0 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.0 5.58 45.12 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -152.14 139.92 19.91 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.311 0.645 . . . . 0.0 109.55 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.479 ' HA ' HD23 ' A' ' 29' ' ' LEU . 32.3 t -52.56 -38.9 60.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.599 1.16 . . . . 0.0 111.958 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 31' ' ' VAL . 29.6 t-80 -69.84 -39.22 76.56 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.67 0.388 . . . . 0.0 111.345 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -56.86 -47.84 79.46 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.592 0.71 . . . . 0.0 110.911 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.696 HD11 HH11 ' A' ' 33' ' ' ARG . 0.2 OUTLIER -63.99 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.582 175.376 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.42 -27.86 68.84 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.866 0.866 . . . . 0.0 112.162 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.605 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 70.9 t -61.11 -45.2 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 124.039 0.935 . . . . 0.0 110.666 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.26 -36.65 74.59 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.967 0.507 . . . . 0.0 110.438 173.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.696 HH11 HD11 ' A' ' 29' ' ' LEU . 13.4 ttt180 -68.76 6.82 0.77 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.308 1.043 . . . . 0.0 112.608 -170.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptm -45.91 -15.67 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 125.901 1.681 . . . . 0.0 114.743 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.08 -54.32 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.309 0 C-N-CA 124.941 1.297 . . . . 0.0 109.05 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.549 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -107.3 2.03 24.25 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 -173.666 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.0 t -82.29 -41.43 20.16 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 120.058 1.299 . . . . 0.0 113.81 -165.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.04 -31.26 8.76 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.155 0.422 . . . . 0.0 114.155 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.48 ' H ' HG23 ' A' ' 37' ' ' THR . 2.2 mp0 -84.37 -51.26 7.1 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 117.231 0.516 . . . . 0.0 110.226 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 67.17 99.8 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.693 1.597 . . . . 0.0 111.546 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.605 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 73.9 Cg_endo -69.87 -147.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.985 2.457 . . . . 0.0 111.905 170.582 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.0 mt -129.32 116.95 19.86 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.739 -0.6 . . . . 0.0 111.726 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -108.98 142.74 39.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.953 0.901 . . . . 0.0 109.334 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.482 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 13.5 t -64.49 112.18 3.02 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 124.702 1.201 . . . . 0.0 109.689 170.058 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -79.52 29.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.0 1.32 . . . . 0.0 111.77 -174.093 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.482 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 2.8 mp -119.95 -16.0 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 124.494 1.118 . . . . 0.0 108.759 -173.808 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 1.4 p -175.97 -134.29 0.01 OUTLIER 'General case' 0 C--O 1.245 0.852 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 -156.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.552 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.94 131.48 4.14 Favored Glycine 0 C--N 1.309 -0.95 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 169.76 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 39.5 t80 176.9 113.37 0.03 OUTLIER 'General case' 0 C--N 1.349 0.573 0 N-CA-C 101.954 -3.35 . . . . 0.0 101.954 -175.248 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.0 m -128.73 139.99 51.95 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -166.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 57' ' ' LEU . 19.3 p -153.78 166.06 34.06 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.166 -174.346 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -88.88 -31.07 18.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.264 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 138.0 38.63 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.699 0.8 . . . . 0.0 109.121 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -36.05 82.59 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -174.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.39 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -55.49 -47.91 75.42 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 -173.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 2.0 pt? -76.41 -37.44 57.07 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.487 0.585 . . . . 0.0 111.044 173.922 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.8 -44.61 66.74 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.808 0.843 . . . . 0.0 113.034 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.419 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 100.0 m95 -80.9 -36.92 30.55 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.74 -177.231 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 58.5 t60 -53.84 -33.33 55.93 Favored 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 165.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.44 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 68.2 mtm -72.82 -37.86 67.35 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.449 0.568 . . . . 0.0 110.425 174.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -59.01 -34.16 71.55 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.808 0.843 . . . . 0.0 111.281 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 68' ' ' SER . 33.8 mmtp -56.87 -28.78 62.22 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.641 172.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -89.6 -24.3 21.73 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.67 0.388 . . . . 0.0 110.745 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.418 ' HA ' ' HB2' ' A' ' 75' ' ' ASN . 20.8 t70 -53.08 -64.63 0.76 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.462 1.101 . . . . 0.0 111.647 -162.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.581 ' HA ' HG11 ' A' ' 87' ' ' VAL . . . -110.79 16.08 21.54 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.471 -1.241 . . . . 0.0 109.422 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.495 ' HB2' ' HB2' ' A' ' 73' ' ' SER . 30.2 t0 57.76 71.68 0.56 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.935 1.694 . . . . 0.0 112.551 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.489 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 75.7 m -80.64 -9.15 59.8 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.154 -1.385 . . . . 0.0 110.985 166.49 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -74.35 -40.54 62.07 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.907 0.883 . . . . 0.0 109.418 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -125.54 -96.98 0.43 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.23 -82.67 0.64 Allowed 'General case' 0 C--N 1.357 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.643 -173.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -155.06 129.04 8.76 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.495 ' HB2' ' HB2' ' A' ' 67' ' ' ASP . 20.0 m -159.51 165.46 32.95 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.492 1.517 . . . . 0.0 108.423 177.127 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -95.3 124.64 39.44 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 167.065 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.418 ' HB2' ' HA ' ' A' ' 65' ' ' ASP . 41.2 t30 -54.11 -39.29 66.26 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.296 0.569 . . . . 0.0 111.692 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 mt -86.12 -47.49 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.5 -166.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 20.3 p -126.99 3.42 6.53 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 119.319 0.963 . . . . 0.0 112.697 -175.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 52.61 37.87 51.21 Favored Glycine 0 C--N 1.361 1.972 0 N-CA-C 114.783 0.673 . . . . 0.0 114.783 174.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -30.29 71.4 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 122.83 0.452 . . . . 0.0 111.276 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt 75.11 122.34 0.04 OUTLIER 'General case' 0 C--N 1.36 1.045 0 C-N-CA 125.04 1.336 . . . . 0.0 109.587 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -130.86 162.91 28.58 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.551 0.741 . . . . 0.0 111.717 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.75 -44.46 96.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.399 1.08 . . . . 0.0 111.855 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 85' ' ' ASP . 5.5 ptmm? -140.99 156.33 46.06 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.353 0.661 . . . . 0.0 109.729 -173.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -60.85 -31.56 70.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.328 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.469 ' HB2' ' HG3' ' A' ' 83' ' ' LYS . 8.3 m-20 -56.32 -43.05 78.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.528 0.731 . . . . 0.0 111.688 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.4 m -64.54 -31.56 72.82 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.033 0.533 . . . . 0.0 111.389 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 66' ' ' ALA . 41.8 t -75.66 -46.14 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.153 0.501 . . . . 0.0 110.479 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 75.9 t -70.92 -38.04 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.15 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.88 90.76 Favored 'General case' 0 C--N 1.349 0.551 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.582 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -70.26 -37.61 74.95 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.881 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.81 -38.45 67.18 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.456 0.702 . . . . 0.0 109.787 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.83 -23.08 65.99 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.983 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -102.75 -49.29 3.85 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.6 t -88.48 -6.93 57.32 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.229 1.011 . . . . 0.0 111.607 -170.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -137.3 67.05 53.59 Favored Pre-proline 0 N--CA 1.478 0.952 0 C-N-CA 122.797 0.439 . . . . 0.0 110.2 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.37 -37.33 5.82 Favored 'Trans proline' 0 C--N 1.378 2.1 0 C-N-CA 121.935 1.756 . . . . 0.0 110.665 169.087 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -131.35 99.89 4.99 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.567 1.626 0 C-N-CA 124.257 1.023 . . . . 0.0 111.918 177.815 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.411 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 91.4 m-70 . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.48 ' SD ' ' N ' ' A' ' 11' ' ' MET . 1.0 OUTLIER -93.85 -39.65 10.59 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.464 1.106 . . . . 0.0 109.799 -177.888 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -108.37 23.67 14.16 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.439 1.095 . . . . 0.0 110.514 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 10' ' ' HIS . 14.3 m-20 -144.64 100.21 3.48 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -86.64 104.48 16.1 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 20' ' ' ALA . 29.4 mm -111.12 133.12 57.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 -173.739 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.464 ' HA ' HD13 ' A' ' 29' ' ' LEU . 41.8 t -54.96 -53.0 61.28 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.853 0.861 . . . . 0.0 110.865 174.997 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 172.15 -53.75 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.972 1.309 . . . . 0.0 108.711 177.377 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -140.59 -45.69 0.41 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -175.361 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 p -88.03 64.64 7.88 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.581 -1.645 . . . . 0.0 109.703 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.443 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -157.7 134.0 9.59 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.063 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -81.16 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 166.363 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.41 124.86 1.46 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.653 0.781 . . . . 0.0 108.986 165.085 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.438 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 96.7 m-85 -102.34 150.59 23.18 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.64 0.776 . . . . 0.0 109.414 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -76.19 -17.24 59.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.847 0.459 . . . . 0.0 112.167 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -146.88 150.36 35.07 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.054 0.541 . . . . 0.0 110.701 -174.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 66.5 p -58.73 -34.21 71.09 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.408 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -74.02 -35.49 64.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.763 0.825 . . . . 0.0 110.955 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -60.62 -48.41 81.89 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.623 0.769 . . . . 0.0 109.906 174.734 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -66.6 -35.07 79.3 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.619 177.136 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.14 68.04 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.29 0.994 . . . . 0.0 111.88 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -56.62 -49.99 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 124.199 1.0 . . . . 0.0 111.411 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -34.9 65.99 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.398 0.618 . . . . 0.0 109.559 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 63.6 ttt180 -63.73 -7.76 8.55 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.682 -175.442 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptm -43.97 -15.19 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.25 -50.42 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.675 0 C-N-CA 124.559 1.143 . . . . 0.0 109.762 175.872 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.61 10.58 38.65 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 125.009 1.323 . . . . 0.0 112.36 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.514 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 9.0 t -55.91 -67.41 0.29 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -155.104 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLY . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' THR . . . 69.81 36.56 74.63 Favored Glycine 0 N--CA 1.473 1.147 0 CA-C-N 118.644 0.656 . . . . 0.0 112.383 -176.712 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -169.74 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.302 1.441 . . . . 0.0 108.181 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 66.53 97.92 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.166 1.386 . . . . 0.0 113.555 164.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.51 164.33 26.22 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.099 1.866 . . . . 0.0 110.046 160.645 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.93 121.32 42.88 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.574 0.75 . . . . 0.0 109.17 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -109.57 143.53 39.14 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -174.222 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 14.5 t -69.57 109.68 4.42 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.725 0.81 . . . . 0.0 109.375 176.633 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 40.63 0.96 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.779 0.832 . . . . 0.0 110.428 -178.012 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.421 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.7 mp -130.97 -12.78 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 C-N-CA 124.945 1.298 . . . . 0.0 108.356 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 4.8 p -175.57 -124.33 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 N-CA-C 102.693 -3.077 . . . . 0.0 102.693 -167.213 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.95 134.69 4.95 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 117.251 -1.86 . . . . 0.0 108.638 163.733 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.8 t80 177.57 115.95 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 102.538 -3.134 . . . . 0.0 102.538 -176.441 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 m -110.48 146.19 36.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.504 0.669 . . . . 0.0 109.724 -171.027 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 43.6 t -144.83 -170.95 3.52 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 125.675 1.59 . . . . 0.0 107.886 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 14.5 ptm180 -131.94 -19.96 2.54 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.694 0.798 . . . . 0.0 110.717 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.635 HE22 ' HB3' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -102.26 125.06 48.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.173 0.989 . . . . 0.0 108.353 -179.329 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -52.9 -56.08 18.57 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.472 1.109 . . . . 0.0 113.266 -172.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.635 ' HB3' HE22 ' A' ' 53' ' ' GLN . . . -53.71 -39.66 65.4 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.048 0.539 . . . . 0.0 112.193 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.565 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 23.5 t -54.75 -55.74 26.71 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.557 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.0 pt? -74.07 -26.31 60.32 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.042 0.383 . . . . 0.0 110.866 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' MET . 6.0 t30 -62.88 -25.11 68.14 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.609 0.764 . . . . 0.0 112.126 169.747 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.2 m95 -82.62 -39.1 22.63 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.62 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 63.1 t60 -58.33 -31.12 67.25 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 169.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 26.2 ptm -71.7 -31.44 66.75 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 119.496 1.044 . . . . 0.0 110.329 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -61.29 -32.67 72.52 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.126 0.571 . . . . 0.0 111.311 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 27.5 mmmt -62.66 -35.86 81.0 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.832 170.584 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -71.85 -25.6 62.03 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.244 0.617 . . . . 0.0 111.584 170.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -82.98 -15.12 52.49 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.9 -57.14 6.73 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.42 170.242 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 75.99 -36.01 0.27 Allowed 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 125.385 1.474 . . . . 0.0 112.849 174.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 34.0 t -62.78 -13.74 36.84 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.086 1.354 . . . . 0.0 113.55 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -57.57 -45.84 84.72 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.047 0.539 . . . . 0.0 111.158 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 40.94 69.75 0.31 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.896 1.372 . . . . 0.0 110.88 -169.803 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.13 -36.12 74.66 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.935 -166.839 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -120.05 160.34 23.0 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 124.45 1.1 . . . . 0.0 109.675 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.596 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 13.3 p -145.14 165.39 28.44 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 125.079 1.352 . . . . 0.0 109.498 178.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.8 t -109.55 115.35 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.944 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 65.1 t30 -67.75 -14.64 63.12 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.492 HD11 ' HE3' ' A' ' 91' ' ' LYS . 2.6 mt -90.06 -38.6 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.423 0.689 . . . . 0.0 112.078 -174.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -137.76 -1.72 2.0 Allowed 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.59 38.78 93.58 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 113.895 0.318 . . . . 0.0 113.895 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -40.47 92.07 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 122.923 0.489 . . . . 0.0 111.672 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 14.0 mptt 72.54 116.81 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.947 1.299 . . . . 0.0 111.034 -177.327 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -125.1 163.67 21.89 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.854 0.862 . . . . 0.0 111.176 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -73.66 -44.85 55.67 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.741 0.816 . . . . 0.0 112.419 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -145.7 163.4 35.02 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.727 0.411 . . . . 0.0 111.793 -167.635 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -49.67 -39.35 36.21 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 125.488 1.515 . . . . 0.0 112.062 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.91 -46.25 67.93 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.458 1.099 . . . . 0.0 111.154 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -71.98 -35.75 69.6 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.517 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -75.28 -51.04 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 123.963 0.905 . . . . 0.0 111.345 -170.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.01 -34.38 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.257 -172.396 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.92 88.57 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.304 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.18 -33.7 67.88 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.998 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.492 ' HE3' HD11 ' A' ' 76' ' ' ILE . 87.2 tttt -73.12 -44.36 60.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.322 0.582 . . . . 0.0 110.171 -178.622 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.76 -22.54 67.01 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.768 -1.105 . . . . 0.0 112.174 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -106.35 -50.19 3.2 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.1 t -90.66 -9.3 47.38 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.52 0.728 . . . . 0.0 111.49 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.8 m-70 -139.08 62.74 27.38 Favored Pre-proline 0 N--CA 1.484 1.266 0 C-N-CA 123.295 0.638 . . . . 0.0 110.634 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -66.43 -25.57 48.49 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.577 2.185 . . . . 0.0 111.634 174.96 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -123.77 95.47 4.58 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.67 1.188 . . . . 0.0 108.026 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 CA--C 1.558 1.257 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.583 178.326 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.4 m80 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.777 0.322 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.7 mmt -128.19 -54.03 1.28 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.315 1.446 . . . . 0.0 108.907 175.104 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -126.72 55.4 1.54 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -129.25 83.27 2.13 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -170.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -97.8 120.89 39.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.573 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.686 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -118.42 157.87 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.067 0.947 . . . . 0.0 109.147 -164.825 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.688 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.9 t -96.74 -12.37 23.82 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.186 0.594 . . . . 0.0 110.744 176.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.686 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.5 tt0 97.59 -20.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 126.513 1.925 . . . . 0.0 111.065 167.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -135.9 -51.5 0.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.871 0.843 . . . . 0.0 109.138 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.9 p -121.17 72.67 1.0 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.464 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.688 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.03 145.74 4.32 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.966 0.889 . . . . 0.0 112.694 163.09 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.13 -168.23 1.05 Allowed 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 113.318 -1.764 . . . . 0.0 109.377 162.577 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.75 125.44 30.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.19 0.596 . . . . 0.0 109.823 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.588 ' HE1' ' HB1' ' A' ' 20' ' ' ALA . 77.1 m-85 -111.53 148.88 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.742 0.817 . . . . 0.0 109.044 174.634 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -61.98 -30.17 70.76 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.091 0.556 . . . . 0.0 111.669 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 53.1 m -144.85 151.06 38.18 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.32 0.648 . . . . 0.0 110.83 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.534 ' HA ' HD23 ' A' ' 29' ' ' LEU . 34.4 t -57.55 -37.11 72.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.871 0.868 . . . . 0.0 111.462 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 -69.54 -35.25 75.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.028 0.931 . . . . 0.0 111.98 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.92 -45.88 91.77 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.462 0.648 . . . . 0.0 110.643 174.681 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -68.36 -29.54 68.28 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.676 174.274 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.75 -26.31 68.63 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.349 0.66 . . . . 0.0 111.568 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 64.1 t -61.84 -47.64 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 122.845 0.458 . . . . 0.0 110.241 171.426 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -62.32 -38.4 89.29 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.732 0.813 . . . . 0.0 110.407 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -65.29 2.37 0.86 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.733 1.213 . . . . 0.0 112.214 -175.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.1 ptp -44.81 -19.48 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 125.209 1.404 . . . . 0.0 113.425 171.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.9 tp -86.52 -51.02 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 125.538 1.535 . . . . 0.0 110.572 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.87 5.33 40.93 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 123.451 0.7 . . . . 0.0 112.235 -173.465 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.7 t -59.32 -57.33 13.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -164.084 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.67 -31.66 2.18 Favored Glycine 0 CA--C 1.538 1.53 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 -169.191 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.43 -45.82 57.87 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 109.91 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt 66.42 98.3 0.04 OUTLIER Pre-proline 0 C--N 1.357 0.932 0 O-C-N 124.918 1.386 . . . . 0.0 111.072 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -70.68 -170.89 0.49 Allowed 'Trans proline' 0 C--N 1.382 2.339 0 C-N-CA 122.899 2.399 . . . . 0.0 111.391 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 54' ' ' LYS . 39.8 mt -99.02 119.37 37.67 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -172.013 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 49' ' ' PHE . 50.7 tt0 -135.45 144.38 46.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 122.716 0.407 . . . . 0.0 111.542 -171.841 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 6.6 t -64.93 107.7 1.56 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.174 0.989 . . . . 0.0 110.684 174.665 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.62 14.58 1.25 Allowed 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.175 0.99 . . . . 0.0 112.551 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.45 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 32.3 mm -96.53 -53.66 7.88 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 20.1 p -119.65 -107.15 0.37 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.772 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.517 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.5 166.82 29.68 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 156.05 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.414 ' H ' ' HG3' ' A' ' 43' ' ' GLN . 74.5 t80 168.45 111.26 0.01 OUTLIER 'General case' 0 C--N 1.346 0.452 0 N-CA-C 102.185 -3.265 . . . . 0.0 102.185 175.789 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -115.05 132.93 56.44 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.559 0.695 . . . . 0.0 109.214 -169.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.6 t -149.43 175.28 11.61 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.971 -1.468 . . . . 0.0 109.024 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.6 ppt_? -103.41 3.25 34.88 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.907 0.883 . . . . 0.0 110.891 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -127.9 103.74 7.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.046 0.938 . . . . 0.0 108.645 -174.281 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.486 ' HB3' HD13 ' A' ' 42' ' ' LEU . 21.0 ptmt -58.6 -28.83 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.568 0.747 . . . . 0.0 112.57 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.19 -39.79 70.01 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.926 0.89 . . . . 0.0 111.829 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.4 t -63.22 -54.64 34.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.768 0.827 . . . . 0.0 111.172 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.538 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -74.29 -27.67 60.83 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.98 0.512 . . . . 0.0 112.224 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.457 ' O ' ' HG2' ' A' ' 61' ' ' MET . 44.3 t30 -51.48 -51.66 53.16 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.603 0.761 . . . . 0.0 112.17 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -81.75 -32.41 31.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.564 0.221 . . . . 0.0 111.028 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.538 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 76.0 t60 -48.97 -42.43 37.65 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 163.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.528 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 17.2 ptm -70.99 -31.87 68.53 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 119.617 1.099 . . . . 0.0 111.604 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 3.0 tppp? -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.253 0.621 . . . . 0.0 111.351 170.721 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 69' ' ' PHE . 48.0 mmtm -63.12 -36.51 83.84 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.624 0.369 . . . . 0.0 110.58 172.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.6 m-70 -78.56 -33.08 48.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.556 0.742 . . . . 0.0 109.86 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.402 ' HB3' ' HA ' ' A' ' 62' ' ' LYS . 35.5 t70 -84.28 -23.47 30.33 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.663 -170.539 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 75' ' ' ASN . . . -108.07 -0.25 21.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.975 0.91 . . . . 0.0 111.653 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.409 ' HB2' ' HB3' ' A' ' 73' ' ' SER . 5.7 m-20 57.57 17.71 4.14 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 124.022 0.929 . . . . 0.0 112.26 -174.355 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.2 m -78.21 -11.13 59.9 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.303 1.041 . . . . 0.0 111.412 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.436 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 48.2 t80 -71.33 -41.14 70.21 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.016 0.526 . . . . 0.0 109.699 177.452 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -79.3 -86.53 0.07 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.057 0.543 . . . . 0.0 110.037 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -112.33 -95.33 0.44 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.645 0.657 . . . . 0.0 109.944 177.375 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -153.88 132.46 12.16 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 -172.05 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.409 ' HB3' ' HB2' ' A' ' 67' ' ' ASP . 33.4 t -158.22 165.13 35.63 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.349 0.66 . . . . 0.0 110.556 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 12.1 t -90.14 125.04 35.31 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 172.337 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.538 ' HA ' ' HA ' ' A' ' 66' ' ' ALA . 2.8 t-20 -52.87 -30.68 35.26 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.815 0.846 . . . . 0.0 113.153 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -103.79 -30.92 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -163.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 18.8 p -136.85 -0.31 2.33 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.863 0.756 . . . . 0.0 112.099 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 59.56 34.35 81.04 Favored Glycine 0 C--N 1.358 1.779 0 N-CA-C 114.301 0.48 . . . . 0.0 114.301 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 7.6 tmtt? -63.37 -30.62 71.72 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.462 1.105 . . . . 0.0 112.442 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm 74.13 116.69 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.742 1.217 . . . . 0.0 111.28 175.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.411 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 94.9 m-85 -131.32 159.37 38.08 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.693 0.797 . . . . 0.0 110.269 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.34 -31.18 67.07 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.422 0.689 . . . . 0.0 111.729 -177.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 86' ' ' SER . 18.2 ptpt -134.04 148.06 51.02 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.55 -35.56 68.27 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.916 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.98 -45.96 71.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.149 0.979 . . . . 0.0 111.132 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.426 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 19.9 t -69.32 -28.36 66.18 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.043 0.537 . . . . 0.0 110.839 -176.919 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 87.0 t -70.57 -46.77 68.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.019 0.928 . . . . 0.0 109.967 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.1 t -71.93 -36.22 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.819 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.36 79.48 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.622 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -70.9 -34.55 71.68 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.529 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -38.53 71.1 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.089 0.956 . . . . 0.0 109.351 -174.438 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.51 -18.13 63.65 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.778 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -96.51 -49.78 5.0 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.422 0.689 . . . . 0.0 110.792 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.0 t -82.79 -32.31 27.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.255 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.418 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 13.7 m-70 -136.16 54.51 9.8 Favored Pre-proline 0 CA--C 1.573 1.85 0 C-N-CA 122.761 0.424 . . . . 0.0 111.505 -171.702 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.418 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 24.2 Cg_exo -63.5 -36.52 53.81 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 122.038 1.825 . . . . 0.0 111.381 170.475 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -115.92 97.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.941 1.296 . . . . 0.0 107.634 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 C--O 1.253 1.25 0 C-N-CA 124.471 1.108 . . . . 0.0 109.128 176.793 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 . . . . . 0 CA--C 1.557 1.247 0 N-CA-C 111.105 0.039 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.8 ptp -165.44 -41.12 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.978 0.511 . . . . 0.0 112.261 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.95 69.88 1.36 Allowed 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.402 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 3.2 p-10 -172.95 103.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.676 -172.507 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -84.76 124.85 32.01 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.334 0.654 . . . . 0.0 110.74 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.588 HG22 ' H ' ' A' ' 17' ' ' GLU . 5.3 mm -115.03 150.77 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 -172.633 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.691 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 t -83.97 -19.1 35.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.2 0.6 . . . . 0.0 109.492 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 15' ' ' ILE . 32.4 tt0 77.06 0.37 3.05 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.787 1.635 . . . . 0.0 110.701 173.635 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -136.16 -50.48 0.69 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.107 0.963 . . . . 0.0 108.612 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.36 77.05 1.53 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.56 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.691 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.52 137.37 2.26 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.942 0.897 . . . . 0.0 110.948 167.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.429 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 ptt180 -70.3 -77.95 0.08 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.337 168.485 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.429 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -163.44 149.42 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.449 0.7 . . . . 0.0 110.233 171.087 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -126.83 152.63 46.73 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.379 0.671 . . . . 0.0 110.258 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -61.76 -32.62 72.89 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.63 0.772 . . . . 0.0 112.357 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -147.63 160.04 43.1 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.887 0.375 . . . . 0.0 111.118 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 p -56.68 -35.67 68.73 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.259 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -75.9 -35.55 59.77 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.0 0.92 . . . . 0.0 112.501 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -50.41 69.88 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.158 0.98 . . . . 0.0 109.041 169.602 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -60.02 -40.2 88.46 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 113.767 -1.56 . . . . 0.0 112.523 172.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.615 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -56.47 -26.9 55.54 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.617 0.767 . . . . 0.0 112.571 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.451 HG13 HG21 ' A' ' 50' ' ' THR . 85.5 t -60.35 -44.96 97.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 123.862 0.865 . . . . 0.0 110.681 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -72.15 -45.98 58.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.523 0.729 . . . . 0.0 110.769 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.615 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 29.8 ttt180 -63.39 -5.13 3.23 Favored 'General case' 0 C--O 1.212 -0.92 0 C-N-CA 125.779 1.632 . . . . 0.0 111.467 -174.844 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.5 ptm -47.44 -12.91 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 125.338 1.455 . . . . 0.0 114.69 173.923 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -83.99 -52.57 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.579 0 C-N-CA 124.715 1.206 . . . . 0.0 109.431 173.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -104.7 1.41 29.35 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.7 t -70.74 -49.61 45.04 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -165.003 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.94 -30.55 3.55 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-O 120.01 -0.328 . . . . 0.0 112.403 -164.526 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -103.8 76.87 1.41 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 124.713 1.205 . . . . 0.0 108.444 175.027 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -52.79 131.56 47.59 Favored Pre-proline 0 CA--C 1.558 1.272 0 C-N-CA 123.333 0.653 . . . . 0.0 111.969 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.85 -172.87 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.568 2.179 . . . . 0.0 111.238 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.4 mt -103.06 99.36 9.24 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.51 134.15 55.31 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -166.751 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.431 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 23.2 t -74.66 106.65 6.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.896 0.878 . . . . 0.0 110.189 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.11 42.26 1.02 Allowed 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.164 0.983 . . . . 0.0 110.493 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.431 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.3 mp -127.78 -2.28 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.563 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 6.6 p 173.71 -136.79 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 -168.547 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.503 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -144.39 127.07 2.84 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.889 -2.084 . . . . 0.0 107.889 171.184 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.9 t80 179.7 112.02 0.04 OUTLIER 'General case' 0 C--O 1.237 0.434 0 N-CA-C 102.147 -3.279 . . . . 0.0 102.147 -167.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.451 HG21 HG13 ' A' ' 31' ' ' VAL . 2.9 m -123.56 144.96 49.24 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.612 0.72 . . . . 0.0 109.804 -170.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 81.6 m -147.26 171.16 15.84 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.696 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.491 ' H ' ' HD2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -117.42 -7.2 11.18 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.887 170.198 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -102.83 111.77 24.26 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 169.128 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -58.32 -33.88 69.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.604 0.761 . . . . 0.0 111.277 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.64 -42.82 71.72 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 124.456 1.098 . . . . 0.0 112.413 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -55.27 -53.78 51.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.967 0.907 . . . . 0.0 112.442 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.596 ' H ' HD23 ' A' ' 57' ' ' LEU . 1.1 pt? -75.86 -27.39 57.78 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.066 0.547 . . . . 0.0 111.567 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 61' ' ' MET . 67.0 t30 -55.1 -44.76 75.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.783 0.833 . . . . 0.0 113.208 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.491 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 66.0 p-90 -82.52 -39.79 21.9 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 122.03 -0.419 . . . . 0.0 110.345 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 75.9 t60 -48.06 -35.25 10.9 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 171.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 23.7 ptp -70.03 -37.56 75.65 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 119.174 0.897 . . . . 0.0 111.043 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 19.4 ttmm -56.93 -37.11 71.04 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.872 0.869 . . . . 0.0 110.699 172.117 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -61.3 -31.39 71.23 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.654 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -73.89 -13.26 60.88 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.302 0.641 . . . . 0.0 111.706 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -103.74 -18.01 14.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 70' ' ' TYR . . . -96.28 -29.22 14.12 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.031 0.932 . . . . 0.0 110.978 -171.708 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -82.97 -5.34 59.04 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.507 0.323 . . . . 0.0 111.231 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.41 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 35.5 p -80.73 -61.9 1.83 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.916 0.886 . . . . 0.0 110.35 -173.582 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.498 ' HD2' ' HG ' ' A' ' 73' ' ' SER . 88.5 m-85 -125.45 -33.16 2.84 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.086 0.554 . . . . 0.0 111.379 177.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.403 ' HB3' ' O ' ' A' ' 66' ' ' ALA . 70.4 t80 -59.69 -32.11 70.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.287 1.035 . . . . 0.0 112.466 -169.27 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 8.4 mm100 -79.57 -81.68 0.11 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -154.76 137.34 15.13 Favored 'General case' 0 C--N 1.345 0.413 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.498 ' HG ' ' HD2' ' A' ' 69' ' ' PHE . 89.3 p -157.52 165.97 34.18 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.801 0.81 . . . . 0.0 111.133 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.66 117.4 30.04 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -67.41 -9.39 41.22 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.337 0.517 . . . . 0.0 112.299 -174.462 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 91' ' ' LYS . 3.2 mt -96.69 -37.39 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.199 0.6 . . . . 0.0 111.905 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.9 p -139.64 8.79 2.39 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 54.0 42.8 71.69 Favored Glycine 0 C--N 1.344 1.019 0 C-N-CA 123.884 0.755 . . . . 0.0 114.885 173.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -66.52 -39.34 88.6 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.41 ' HE3' ' O ' ' A' ' 68' ' ' SER . 11.6 mptt 71.23 117.75 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 124.417 1.087 . . . . 0.0 109.853 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 87.6 m-85 -124.39 170.63 10.64 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.73 0.812 . . . . 0.0 110.148 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HG2' ' A' ' 83' ' ' LYS . 13.7 pt-20 -64.29 -41.34 96.93 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.369 173.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HG2' ' HG3' ' A' ' 82' ' ' GLU . 17.3 ptpt -142.27 157.64 44.6 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.318 0.647 . . . . 0.0 109.554 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -67.7 -21.99 65.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.64 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -60.13 -43.98 95.27 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.495 0.318 . . . . 0.0 110.76 171.565 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.2 m -66.07 -29.28 69.59 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.178 0.591 . . . . 0.0 111.449 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 65.3 t -71.37 -49.18 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.013 0.925 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 96.0 t -74.34 -33.01 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.838 1.255 . . . . 0.0 109.92 -174.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.85 89.02 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.802 173.671 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -73.96 -35.35 64.51 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.272 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 76' ' ' ILE . 85.0 tttt -70.88 -46.7 62.14 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.44 1.096 . . . . 0.0 111.213 -169.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -20.75 66.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.684 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.2 mmtm -99.03 -47.62 5.17 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.117 0.567 . . . . 0.0 111.006 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.2 t -84.84 -20.25 31.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.018 0.927 . . . . 0.0 111.761 -170.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -136.89 65.59 53.12 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 122.975 0.51 . . . . 0.0 110.258 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -50.71 -39.03 57.26 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 123.255 2.637 . . . . 0.0 113.192 169.131 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -108.31 98.44 7.98 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.559 1.144 . . . . 0.0 108.835 -177.656 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.556 1.211 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.432 169.944 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.4 mtp -128.2 -54.18 1.28 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.078 0.951 . . . . 0.0 108.919 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -126.68 83.15 2.14 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.73 101.92 3.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -99.48 115.03 28.35 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.465 HG23 ' HB3' ' A' ' 20' ' ' ALA . 31.6 mm -119.36 134.18 63.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -170.553 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.8 t -57.69 -51.43 69.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.264 1.025 . . . . 0.0 110.711 172.895 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 166.14 -54.08 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 125.758 1.623 . . . . 0.0 109.367 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -137.46 -51.3 0.63 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.308 -169.083 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -90.78 61.39 4.74 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.112 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.465 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -153.94 128.64 9.38 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.02 169.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -69.79 -79.45 0.06 Allowed 'General case' 0 CA--C 1.55 0.942 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 169.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.72 140.63 5.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.204 1.002 . . . . 0.0 108.613 163.473 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.25 145.12 43.39 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.678 0.791 . . . . 0.0 109.044 175.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -78.78 -9.36 59.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.857 0.463 . . . . 0.0 112.035 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -147.06 147.13 30.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.299 0.64 . . . . 0.0 110.77 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.435 ' HA ' HD23 ' A' ' 29' ' ' LEU . 22.6 t -62.09 -34.34 76.12 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.01 0.924 . . . . 0.0 111.844 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -73.25 -33.89 65.54 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 120.803 0.335 . . . . 0.0 110.36 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.79 -42.9 94.42 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.555 0.742 . . . . 0.0 111.127 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.3 OUTLIER -66.0 -34.46 78.14 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.969 175.105 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.18 -27.8 68.67 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 112.324 176.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.486 HG13 HG21 ' A' ' 50' ' ' THR . 79.1 t -63.02 -48.88 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.245 0.618 . . . . 0.0 110.976 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -62.56 -35.09 78.37 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.673 0.789 . . . . 0.0 109.943 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -66.22 4.34 0.72 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.975 1.31 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -46.79 -15.21 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 125.519 1.528 . . . . 0.0 114.622 170.524 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -49.88 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.638 0 C-N-CA 125.346 1.458 . . . . 0.0 110.212 173.812 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.0 -10.43 20.55 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -169.862 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.4 t -72.68 -42.05 64.68 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -161.536 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.12 -29.85 3.06 Favored Glycine 0 CA--C 1.541 1.693 0 CA-C-O 120.401 -0.11 . . . . 0.0 112.986 -165.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -107.79 77.78 1.15 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 125.174 1.389 . . . . 0.0 108.027 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -49.14 133.1 16.07 Favored Pre-proline 0 N--CA 1.491 1.58 0 C-N-CA 123.925 0.89 . . . . 0.0 112.06 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -70.88 -178.63 2.87 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.709 2.273 . . . . 0.0 111.516 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.403 ' N ' HD12 ' A' ' 42' ' ' LEU . 3.8 mp -102.03 90.04 3.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -170.373 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -121.65 142.92 49.66 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.532 0.733 . . . . 0.0 110.177 -172.445 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 40.8 t -69.85 108.1 3.83 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.527 1.131 . . . . 0.0 109.746 174.344 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.55 48.41 1.3 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 122.84 1.305 . . . . 0.0 108.492 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.523 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -126.53 -9.92 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 125.748 1.619 . . . . 0.0 108.049 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 5.8 p 179.61 -123.5 0.0 OUTLIER 'General case' 0 C--N 1.348 0.543 0 N-CA-C 102.758 -3.053 . . . . 0.0 102.758 -162.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.572 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.82 143.81 11.23 Favored Glycine 0 C--N 1.308 -1.001 0 CA-C-O 117.342 -1.81 . . . . 0.0 108.978 159.326 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.4 t80 177.38 112.36 0.03 OUTLIER 'General case' 0 C--N 1.361 1.093 0 N-CA-C 103.052 -2.944 . . . . 0.0 103.052 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.486 HG21 HG13 ' A' ' 31' ' ' VAL . 2.7 m -119.19 148.19 43.38 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 118.712 0.687 . . . . 0.0 109.733 -171.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 87.8 m -152.21 169.06 23.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.509 1.124 . . . . 0.0 110.256 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.1 ttt180 -84.41 -36.42 22.42 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.503 0.721 . . . . 0.0 110.002 170.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -92.67 130.13 38.39 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.462 0.705 . . . . 0.0 109.306 -173.873 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -61.63 -41.44 97.49 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.659 0.784 . . . . 0.0 110.399 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -43.18 65.9 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.72 0.808 . . . . 0.0 112.276 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.0 m -51.94 -53.41 41.44 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.705 0.802 . . . . 0.0 112.434 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.58 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.3 pt? -77.14 -28.55 54.3 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.745 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -61.75 -30.91 71.09 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 118.495 0.588 . . . . 0.0 112.18 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -79.82 -49.47 11.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -49.29 -36.82 21.91 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.4 ' SD ' ' N ' ' A' ' 62' ' ' LYS . 3.6 ppp? -71.02 -35.44 72.02 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.509 1.05 . . . . 0.0 110.309 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.4 ' N ' ' SD ' ' A' ' 61' ' ' MET . 30.1 ttmt -67.06 -28.33 68.11 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.54 0.736 . . . . 0.0 111.462 172.001 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -61.98 -32.23 72.65 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.091 0.556 . . . . 0.0 112.021 170.182 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -75.02 -22.08 58.7 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 122.699 0.4 . . . . 0.0 111.558 170.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -95.63 -19.42 19.76 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.2 -23.5 47.51 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 124.702 1.201 . . . . 0.0 110.668 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.9 t70 64.36 53.98 1.61 Allowed 'General case' 0 C--N 1.361 1.101 0 O-C-N 124.443 1.09 . . . . 0.0 109.5 175.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 46.0 m -91.66 -66.56 0.92 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.295 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -116.57 6.72 13.5 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.842 0.857 . . . . 0.0 111.11 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -118.3 31.63 6.57 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -177.134 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -69.19 -32.79 72.33 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.793 -166.972 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -133.51 138.4 46.08 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 73.0 p -156.33 165.09 37.38 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 123.709 0.804 . . . . 0.0 110.694 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.575 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 43.9 t -95.77 116.24 28.6 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -60.96 -15.72 34.65 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 122.062 -0.399 . . . . 0.0 111.578 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 mt -97.2 -37.6 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.23 0.612 . . . . 0.0 109.818 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 77' ' ' CYS . 14.1 p -160.05 56.85 0.36 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 121.019 0.438 . . . . 0.0 110.893 -178.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.575 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -25.48 74.26 0.0 OUTLIER Glycine 0 N--CA 1.492 2.392 0 C-N-CA 127.205 2.336 . . . . 0.0 118.265 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -88.46 -8.76 54.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.061 0.944 . . . . 0.0 111.682 171.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? 68.83 107.15 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.564 1.146 . . . . 0.0 110.298 173.691 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -110.59 168.05 9.76 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.044 0.538 . . . . 0.0 111.643 -172.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -59.66 -28.41 67.23 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.071 0.948 . . . . 0.0 112.297 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -163.66 161.72 23.79 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.351 0.661 . . . . 0.0 110.302 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 88' ' ' VAL . 25.0 pttm -65.8 -27.71 68.47 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.175 177.235 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -58.87 -39.68 82.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.575 0.75 . . . . 0.0 111.354 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.4 m -67.39 -31.72 72.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.234 0.613 . . . . 0.0 111.046 174.775 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.03 -40.91 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.732 0.813 . . . . 0.0 110.347 -177.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 84' ' ' LYS . 58.4 t -73.13 -36.16 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.293 1.037 . . . . 0.0 109.225 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 93' ' ' LYS . . . -65.63 -40.68 92.81 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.418 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -71.82 -33.93 68.91 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.633 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -70.37 -33.5 71.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.136 0.974 . . . . 0.0 108.77 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.79 74.33 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.18 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 29.2 mmtp -93.95 -48.49 6.23 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.962 0.41 . . . . 0.0 111.092 -172.13 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -90.34 -23.74 21.04 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.68 0.792 . . . . 0.0 111.239 -171.069 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 -132.81 47.42 2.72 Favored Pre-proline 0 CA--C 1.572 1.796 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.447 -173.779 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -67.31 -26.84 41.2 Favored 'Trans proline' 0 C--N 1.39 2.711 0 C-N-CA 121.861 1.707 . . . . 0.0 112.606 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -138.65 101.47 4.34 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.618 1.167 . . . . 0.0 107.892 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 CA--C 1.562 1.407 0 C-N-CA 123.984 0.913 . . . . 0.0 109.468 173.481 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.6 p80 . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.401 ' SD ' ' HE1' ' A' ' 14' ' ' TYR . 17.8 tpt -71.09 78.39 0.67 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 172.881 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -164.68 93.57 0.65 Allowed 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.86 90.04 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.484 1.113 . . . . 0.0 111.692 172.336 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.401 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 64.9 m-85 -77.91 121.77 24.6 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.599 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.419 HG22 ' H ' ' A' ' 17' ' ' GLU . 20.6 mm -112.81 117.18 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.139 -171.017 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.6 t -57.7 -23.65 52.78 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.527 1.131 . . . . 0.0 111.572 172.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' H ' HG22 ' A' ' 15' ' ' ILE . 42.3 tt0 115.93 -24.84 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.53 0 C-N-CA 127.287 2.235 . . . . 0.0 111.18 164.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -133.81 -48.65 0.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.809 0.814 . . . . 0.0 109.091 -177.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.1 p -114.92 64.02 0.68 Allowed 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.209 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -162.98 112.86 1.38 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.176 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -68.29 -45.17 73.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 169.573 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.58 148.97 2.03 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 123.772 0.829 . . . . 0.0 110.971 157.929 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -118.1 148.04 42.69 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -65.65 -25.54 67.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.4 m -147.02 156.93 43.42 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.964 0.411 . . . . 0.0 111.827 -175.203 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.3 p -59.11 -37.24 76.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.537 170.277 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.402 ' O ' HG23 ' A' ' 31' ' ' VAL . 15.2 m-70 -69.37 -39.26 78.14 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.867 0.867 . . . . 0.0 109.95 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -60.21 -51.06 71.19 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.52 1.128 . . . . 0.0 110.623 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -33.54 75.94 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.86 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.96 69.91 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.962 0.905 . . . . 0.0 112.207 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.566 HG21 ' HE ' ' A' ' 52' ' ' ARG . 25.8 t -68.32 -40.21 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.433 0.458 . . . . 0.0 110.338 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.82 -39.27 69.92 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.542 0.737 . . . . 0.0 109.69 175.717 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -64.08 -6.47 6.48 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.22 1.408 . . . . 0.0 111.614 -176.359 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.505 ' SD ' ' HB ' ' A' ' 50' ' ' THR . 25.9 ptt? -46.94 -15.19 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -54.4 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 125.226 1.41 . . . . 0.0 109.406 176.677 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.96 5.12 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 123.799 0.84 . . . . 0.0 112.98 -175.046 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -62.39 -35.78 80.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.747 0.419 . . . . 0.0 112.085 -168.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.57 -25.24 3.96 Favored Glycine 0 C--N 1.35 1.33 0 O-C-N 123.019 0.199 . . . . 0.0 112.719 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -128.47 89.22 2.86 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -53.56 112.73 3.97 Favored Pre-proline 0 N--CA 1.49 1.554 0 C-N-CA 123.946 0.898 . . . . 0.0 110.651 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.02 -67.35 0.04 OUTLIER 'Trans proline' 0 C--N 1.385 2.459 0 C-N-CA 122.682 2.255 . . . . 0.0 112.124 -173.43 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.5 ' HB3' HD21 ' A' ' 57' ' ' LEU . 85.4 mt -145.67 96.52 2.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.395 1.078 . . . . 0.0 108.458 -176.866 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -132.52 143.06 49.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.372 0.669 . . . . 0.0 110.545 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.4 t -63.91 110.53 2.13 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.335 1.054 . . . . 0.0 110.311 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -84.92 29.73 0.62 Allowed 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 123.845 0.858 . . . . 0.0 111.487 -178.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.35 -56.49 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.497 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.7 p -113.71 -117.67 0.32 Allowed 'General case' 0 C--O 1.239 0.507 0 N-CA-C 102.447 -3.168 . . . . 0.0 102.447 166.912 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.497 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.96 163.74 28.29 Favored Glycine 0 C--N 1.313 -0.696 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 156.32 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.6 t80 172.33 112.55 0.01 OUTLIER 'General case' 0 C--O 1.24 0.566 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.505 ' HB ' ' SD ' ' A' ' 34' ' ' MET . 3.4 m -114.3 138.05 51.01 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -173.076 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -144.97 162.06 37.84 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.761 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.566 ' HE ' HG21 ' A' ' 31' ' ' VAL . 38.0 ttm180 -76.98 -31.61 56.65 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.575 175.828 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 8.1 tt0 -106.71 122.16 45.8 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.701 0.8 . . . . 0.0 109.685 -178.877 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -49.43 -47.59 47.98 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.63 1.172 . . . . 0.0 111.974 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -53.44 -31.85 47.21 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.127 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -63.43 -56.04 19.4 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.676 0.39 . . . . 0.0 111.371 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -75.06 -30.72 61.07 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.958 0.503 . . . . 0.0 111.646 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.02 -48.58 64.43 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.606 1.162 . . . . 0.0 112.776 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.439 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 8.8 m95 -77.06 -42.41 38.47 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.944 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 59.6 t60 -46.42 -41.36 13.63 Favored 'General case' 0 CA--C 1.569 1.678 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 168.708 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.524 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 75.0 mtm -71.41 -43.15 67.31 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 118.217 0.462 . . . . 0.0 111.562 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -60.31 -25.36 65.72 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 123.025 0.53 . . . . 0.0 111.855 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 32.6 mmmt -62.4 -38.59 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.924 0.49 . . . . 0.0 110.559 171.956 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.524 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 98.6 m-70 -65.17 -26.62 68.24 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 123.051 0.54 . . . . 0.0 111.085 172.154 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -90.15 -11.2 41.86 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.228 0.611 . . . . 0.0 109.776 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.2 -48.76 32.44 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 123.693 0.797 . . . . 0.0 109.141 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 73.28 -26.21 0.19 Allowed 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.668 1.187 . . . . 0.0 113.566 176.902 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.3 t -62.75 -9.98 11.19 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.713 1.205 . . . . 0.0 113.503 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -120.04 -21.73 6.96 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.98 0.912 . . . . 0.0 109.527 -176.201 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -111.06 -9.69 14.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.029 -169.224 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -118.93 8.73 11.74 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.697 -177.78 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -139.16 133.48 31.51 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -175.295 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.8 p -161.96 121.34 2.41 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.499 1.12 . . . . 0.0 109.148 -174.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.617 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 0.9 OUTLIER -72.16 135.56 46.2 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 167.062 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.5 -27.07 65.82 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.975 0.91 . . . . 0.0 113.409 -174.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.426 HD11 ' HA ' ' A' ' 98' ' ' VAL . 2.6 mt -113.08 -38.55 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 122.919 0.487 . . . . 0.0 110.308 -170.237 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.9 p -150.37 64.37 0.95 Allowed 'General case' 0 C--N 1.353 0.759 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -177.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.617 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -35.98 77.86 0.0 OUTLIER Glycine 0 C--N 1.355 1.627 0 C-N-CA 125.13 1.347 . . . . 0.0 116.407 167.815 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -68.41 -28.75 67.36 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.127 0.971 . . . . 0.0 110.989 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? 74.52 111.37 0.07 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 124.924 1.29 . . . . 0.0 110.387 -174.819 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -116.6 155.82 28.06 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.17 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -29.97 66.29 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -135.4 150.96 50.02 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 122.82 0.448 . . . . 0.0 109.859 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -60.73 -30.4 69.96 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.977 0.911 . . . . 0.0 111.052 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -53.16 -45.8 68.63 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.828 0.705 . . . . 0.0 110.874 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.0 m -68.03 -30.46 69.7 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 t -74.56 -46.42 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.203 0.601 . . . . 0.0 110.024 -176.46 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -73.32 -37.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.664 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.65 -40.73 92.8 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 124.221 0.951 . . . . 0.0 109.354 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.99 -37.72 78.9 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.322 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -70.8 -41.19 71.94 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.804 0.841 . . . . 0.0 109.835 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.98 -28.72 68.49 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.273 0.629 . . . . 0.0 111.301 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -82.13 -53.53 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.539 1.136 . . . . 0.0 110.965 -174.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.03 -15.57 16.73 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.213 -166.524 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -137.11 52.73 5.94 Favored Pre-proline 0 CA--C 1.57 1.747 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -173.213 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -60.83 -22.35 73.5 Favored 'Trans proline' 0 C--N 1.391 2.777 0 C-N-CA 122.121 1.881 . . . . 0.0 112.379 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -115.85 96.47 5.61 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 171.232 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.426 ' HA ' HD11 ' A' ' 76' ' ' ILE . 69.7 t . . . . . 0 C--O 1.255 1.371 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.913 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.0 mtm 62.65 29.56 16.88 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 124.345 1.058 . . . . 0.0 110.913 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.525 HH11 ' HA ' ' A' ' 24' ' ' LYS . 34.4 ttp85 -169.36 71.22 0.07 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.588 1.555 . . . . 0.0 106.821 -174.127 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -141.13 97.38 3.16 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -169.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 81.7 m-85 -91.55 108.03 19.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.164 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.1 mm -109.15 149.74 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 25.4 t -94.01 -23.86 17.86 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 0.0 110.505 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 113.97 -27.18 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 128.533 2.733 . . . . 0.0 111.024 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -135.88 -51.66 0.73 Allowed 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.652 0.739 . . . . 0.0 109.927 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 p -113.34 57.27 0.68 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.833 -172.481 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.628 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -159.91 116.12 2.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.962 0.905 . . . . 0.0 109.578 165.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -68.34 -48.92 63.55 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.07 164.28 9.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.368 1.067 . . . . 0.0 109.627 160.62 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.483 ' HB2' ' HB2' ' A' ' 14' ' ' TYR . 88.5 m-85 -131.27 143.54 50.63 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.516 0.726 . . . . 0.0 109.815 167.731 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.525 ' HA ' HH11 ' A' ' 12' ' ' ARG . 25.9 ttpp -74.81 -24.83 58.69 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.071 0.948 . . . . 0.0 110.791 173.032 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -139.85 140.2 36.49 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.692 0.797 . . . . 0.0 110.336 -171.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.8 t -67.78 -25.88 65.83 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.234 172.687 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 26.4 m80 -70.44 -38.19 74.47 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.816 0.446 . . . . 0.0 110.799 174.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.66 -44.79 85.24 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 122.136 0.97 . . . . 0.0 109.617 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.64 -37.35 81.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.661 -1.609 . . . . 0.0 110.999 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.68 74.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.644 0.777 . . . . 0.0 112.23 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.689 HG13 ' HB ' ' A' ' 50' ' ' THR . 87.3 t -62.94 -44.74 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.649 0.78 . . . . 0.0 110.468 176.513 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -69.27 -38.02 78.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.84 0.856 . . . . 0.0 110.732 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.498 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 37.3 ttp180 -70.04 0.74 5.51 Favored 'General case' 0 C--O 1.21 -0.986 0 C-N-CA 124.319 1.047 . . . . 0.0 111.743 -172.471 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -46.43 -17.56 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 124.895 1.278 . . . . 0.0 114.319 172.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -54.17 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 124.427 1.091 . . . . 0.0 109.449 174.041 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -96.39 7.98 45.15 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.887 0.875 . . . . 0.0 111.658 -170.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 3.6 t -56.3 -64.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -156.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.6 35.69 75.02 Favored Glycine 0 N--CA 1.474 1.188 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.409 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 38.4 mt-10 -146.1 -38.01 0.24 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.567 1.547 . . . . 0.0 108.122 -169.46 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt 72.16 78.21 0.2 Allowed Pre-proline 0 C--N 1.358 0.95 0 C-N-CA 125.483 1.513 . . . . 0.0 109.9 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.43 170.01 19.09 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 122.82 2.347 . . . . 0.0 111.384 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.7 mt -111.48 140.62 45.92 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.674 0.79 . . . . 0.0 109.757 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 143.66 50.99 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -173.454 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.0 t -63.56 106.52 0.96 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.43 -29.18 33.98 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.909 1.283 . . . . 0.0 112.027 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.6 mm -74.29 -47.9 38.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 123.17 0.588 . . . . 0.0 109.985 -176.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.0 p -142.96 -89.36 0.13 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 120.586 0.231 . . . . 0.0 111.109 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.602 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -156.23 132.81 3.44 Favored Glycine 0 C--N 1.339 0.75 0 CA-C-O 116.838 -2.09 . . . . 0.0 109.709 -170.769 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.1 t80 168.1 112.91 0.01 OUTLIER 'General case' 0 C--N 1.353 0.752 0 N-CA-C 103.065 -2.939 . . . . 0.0 103.065 170.652 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.689 ' HB ' HG13 ' A' ' 31' ' ' VAL . 2.9 m -113.63 134.98 54.41 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -175.368 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 4.8 p -159.62 159.16 32.82 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 124.089 0.868 . . . . 0.0 110.891 176.582 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.46 -10.68 59.44 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.319 1.048 . . . . 0.0 111.252 176.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -103.01 109.31 20.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.392 1.077 . . . . 0.0 108.994 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -52.06 -42.47 63.17 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.467 0.707 . . . . 0.0 111.712 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.89 -41.73 64.63 Favored 'General case' 0 CA--C 1.556 1.186 0 O-C-N 124.698 1.249 . . . . 0.0 111.999 177.076 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.599 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 20.0 t -61.19 -52.63 64.01 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.643 0.777 . . . . 0.0 111.653 -173.502 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.478 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.9 OUTLIER -74.25 -33.42 63.32 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.315 178.083 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -52.35 -42.29 63.77 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.826 0.851 . . . . 0.0 112.637 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -80.14 -38.49 31.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -177.929 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.8 t60 -48.26 -34.19 9.93 Favored 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 162.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.41 -35.14 70.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 172.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -61.03 -27.41 68.31 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 167.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.519 ' HE2' ' HB3' ' A' ' 70' ' ' TYR . 52.2 mtpt -68.98 -31.15 69.79 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.845 0.458 . . . . 0.0 110.243 173.735 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -70.58 -20.34 62.78 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.41 0.684 . . . . 0.0 111.261 173.282 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -69.68 -39.15 77.15 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.922 0.489 . . . . 0.0 110.547 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -42.43 63.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.12 0.568 . . . . 0.0 109.803 171.195 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.1 t70 85.72 -70.07 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 113.881 -1.509 . . . . 0.0 111.311 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 t -61.56 -34.13 75.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.567 1.147 . . . . 0.0 113.458 -167.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -138.45 7.34 2.58 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.375 0.67 . . . . 0.0 111.603 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.519 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 58.5 m-85 60.01 2.3 0.4 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 176.561 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -93.63 -110.91 0.11 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 80' ' ' LYS . 99.0 m-85 -144.22 137.55 27.42 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 61.0 p -140.73 132.56 27.5 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 123.301 0.64 . . . . 0.0 110.09 -169.082 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.0 t -76.35 126.5 31.11 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.046 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.45 -27.83 69.38 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.526 0.603 . . . . 0.0 111.462 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.672 HD13 HG21 ' A' ' 98' ' ' VAL . 2.8 mt -88.24 -44.08 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.968 -170.785 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -131.69 -2.73 3.74 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 119.231 0.923 . . . . 0.0 112.335 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.17 31.72 56.51 Favored Glycine 0 C--N 1.362 2.001 0 N-CA-C 115.004 0.762 . . . . 0.0 115.004 174.493 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -62.61 -23.4 67.03 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.598 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 72' ' ' PHE . 43.9 mmtm 77.8 118.62 0.06 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.826 1.25 . . . . 0.0 111.228 175.762 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -125.7 162.57 24.73 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.69 0.796 . . . . 0.0 111.832 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -72.3 -32.5 66.65 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.856 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -150.14 165.34 33.13 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-O 121.014 0.435 . . . . 0.0 111.395 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -56.13 -40.66 74.11 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.931 1.293 . . . . 0.0 111.528 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.87 -41.97 68.1 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.045 0.841 . . . . 0.0 111.503 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.0 m -66.13 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.647 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.9 t -76.3 -42.9 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 C-N-CA 123.728 0.811 . . . . 0.0 110.11 -174.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.7 -41.39 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.301 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.74 -36.58 80.83 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 113.966 -1.47 . . . . 0.0 109.742 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -68.25 -45.15 73.99 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.572 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 ttpt -70.16 -40.26 74.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.693 0.797 . . . . 0.0 109.715 -167.955 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.3 -30.38 66.6 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.061 177.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -102.76 -40.64 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.46 0.704 . . . . 0.0 111.742 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.2 t -85.95 -17.78 34.45 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.611 1.165 . . . . 0.0 111.158 -170.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -134.88 58.09 25.93 Favored Pre-proline 0 CA--C 1.567 1.629 0 C-N-CA 123.006 0.522 . . . . 0.0 111.043 -176.498 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -67.21 -39.99 12.15 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 122.221 1.948 . . . . 0.0 111.371 175.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -111.01 94.53 5.04 Favored 'General case' 0 C--N 1.353 0.756 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 173.542 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.672 HG21 HD13 ' A' ' 76' ' ' ILE . 3.0 p . . . . . 0 C--O 1.248 1.011 0 C-N-CA 124.224 1.01 . . . . 0.0 109.711 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 . . . . . 0 CA--C 1.553 1.072 0 CA-C-O 120.952 0.406 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.427 ' HG3' ' HD2' ' A' ' 12' ' ' ARG . 15.6 ptt? -157.22 -40.29 0.07 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.729 0.811 . . . . 0.0 111.056 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD2' ' HG3' ' A' ' 11' ' ' MET . 5.1 mpt_? -86.0 46.6 1.34 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.398 0.618 . . . . 0.0 109.633 172.463 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -128.14 94.23 3.86 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.196 0.998 . . . . 0.0 108.817 -167.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.3 118.77 20.11 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 126.111 1.764 . . . . 0.0 109.077 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.643 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -114.64 151.13 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -173.198 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.648 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 2.2 t -81.61 -23.53 36.97 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.712 0.805 . . . . 0.0 111.281 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.643 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.1 tt0 85.87 -5.46 0.82 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.491 1.516 . . . . 0.0 110.288 174.202 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -134.76 -51.01 0.78 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.447 0.699 . . . . 0.0 109.311 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -144.27 79.37 1.61 Allowed 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.003 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -163.24 129.29 3.25 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.748 1.219 . . . . 0.0 109.293 164.72 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.469 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 35.3 ptt180 -66.61 -59.68 3.39 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.184 0.927 . . . . 0.0 108.731 175.694 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -176.22 146.45 0.66 Allowed 'General case' 0 C--N 1.354 0.777 0 C-N-CA 124.941 1.296 . . . . 0.0 108.519 169.61 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -119.34 139.13 52.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 173.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -89.42 0.38 56.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.313 0.245 . . . . 0.0 110.863 174.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 m -137.75 133.01 33.61 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.282 0.633 . . . . 0.0 110.052 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.8 p -61.79 -38.5 88.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.382 1.073 . . . . 0.0 111.526 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.481 ' O ' HG23 ' A' ' 31' ' ' VAL . 51.7 m-70 -62.48 -40.17 95.8 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.993 0.517 . . . . 0.0 111.47 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.79 -45.11 95.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.718 0.807 . . . . 0.0 110.175 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.42 -40.96 98.26 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.957 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.05 -30.32 71.27 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.227 0.611 . . . . 0.0 111.896 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 27' ' ' HIS . 81.2 t -65.98 -41.54 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.46 0.704 . . . . 0.0 110.465 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -68.44 -40.39 81.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.559 0.744 . . . . 0.0 110.83 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -65.09 -3.34 3.57 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.928 1.291 . . . . 0.0 112.128 -175.116 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -45.16 -24.41 0.25 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 125.193 1.397 . . . . 0.0 114.115 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.6 tp -87.2 -40.47 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 C-N-CA 124.323 1.049 . . . . 0.0 110.598 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -98.57 -19.04 17.82 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -172.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -62.03 -49.06 77.51 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -158.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.97 -31.1 3.75 Favored Glycine 0 C--N 1.338 0.665 0 CA-C-O 120.06 -0.3 . . . . 0.0 112.68 -164.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -111.17 78.85 1.15 Allowed 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 172.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -58.12 121.89 54.48 Favored Pre-proline 0 N--CA 1.478 0.957 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.099 -174.627 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -63.47 -86.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.741 2.294 . . . . 0.0 111.981 -172.468 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -145.55 100.65 3.47 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -142.18 126.95 18.11 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.371 0.668 . . . . 0.0 109.743 -176.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 t -64.67 109.4 2.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.872 1.269 . . . . 0.0 111.27 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -87.6 49.26 1.77 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.759 1.224 . . . . 0.0 110.085 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mm -133.9 -3.47 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.606 0 C-N-CA 125.528 1.531 . . . . 0.0 108.004 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.2 p 179.66 -133.44 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 102.745 -3.058 . . . . 0.0 102.745 -165.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.486 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.68 129.55 3.24 Favored Glycine 0 C--N 1.306 -1.117 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 161.118 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -176.79 113.29 0.1 Allowed 'General case' 0 C--N 1.354 0.803 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 -170.281 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 m -115.55 140.68 48.94 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 63.0 m -133.01 161.58 33.99 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.555 1.142 . . . . 0.0 110.875 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -97.24 -31.88 12.2 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.148 0.979 . . . . 0.0 109.462 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -97.28 130.71 44.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.152 0.981 . . . . 0.0 110.227 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -57.73 -44.03 85.7 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.57 1.148 . . . . 0.0 111.416 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.73 -40.56 69.39 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.591 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 t -56.92 -55.43 34.6 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.738 0.815 . . . . 0.0 112.302 -175.328 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.474 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -75.83 -27.94 58.07 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 119.332 -0.366 . . . . 0.0 111.673 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 61' ' ' MET . 6.3 t30 -58.92 -39.82 82.7 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.787 0.835 . . . . 0.0 112.744 175.268 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -79.69 -45.94 18.04 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 68.7 t60 -48.21 -37.73 16.61 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 168.03 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -72.09 -35.22 69.15 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 119.647 1.112 . . . . 0.0 110.759 178.105 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.45 -31.4 72.11 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.058 0.543 . . . . 0.0 111.277 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -58.54 -30.32 67.01 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.933 173.535 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.456 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 96.8 m-70 -77.27 -10.73 59.61 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.064 0.546 . . . . 0.0 111.798 175.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -91.58 -33.74 15.01 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.602 0.361 . . . . 0.0 110.811 -171.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.79 3.9 19.44 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.169 0.588 . . . . 0.0 110.484 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -44.24 81.37 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.916 2.086 . . . . 0.0 114.203 -171.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 26.1 m -79.37 -13.16 59.8 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.239 -1.346 . . . . 0.0 111.495 171.62 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -70.15 -35.06 73.77 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.682 0.393 . . . . 0.0 110.032 171.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 58.47 81.12 0.16 Allowed 'General case' 0 C--N 1.354 0.773 0 C-N-CA 124.783 1.233 . . . . 0.0 110.721 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -65.84 -43.13 89.42 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.617 1.167 . . . . 0.0 111.112 -175.47 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -94.33 140.09 30.24 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.094 0.958 . . . . 0.0 108.638 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 77.2 p -151.49 164.76 36.07 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 123.921 0.888 . . . . 0.0 110.496 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.735 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 5.1 t -100.32 124.18 45.47 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 170.256 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -70.56 -5.4 28.78 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.246 0.475 . . . . 0.0 111.739 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.5 -32.13 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.725 0.81 . . . . 0.0 109.15 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.4 p -170.32 70.59 0.06 Allowed 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLY . . . . . 0.735 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -39.46 76.5 0.0 OUTLIER Glycine 0 N--CA 1.48 1.567 0 N-CA-C 117.672 1.829 . . . . 0.0 117.672 175.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -66.68 -21.87 66.09 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.185 0.994 . . . . 0.0 111.264 171.226 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm 70.86 103.2 0.06 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.987 1.315 . . . . 0.0 109.628 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.403 ' HB3' ' HB3' ' A' ' 86' ' ' SER . 70.2 m-85 -107.41 160.53 15.57 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.297 0.639 . . . . 0.0 111.55 -167.395 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.51 -38.66 81.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.361 1.065 . . . . 0.0 112.629 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -166.66 172.73 10.32 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 123.831 0.707 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -55.6 -34.57 64.98 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.284 1.433 . . . . 0.0 112.578 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -54.86 -45.72 74.6 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 123.801 0.688 . . . . 0.0 111.182 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.403 ' HB3' ' HB3' ' A' ' 81' ' ' PHE . 26.3 t -69.81 -30.83 68.45 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.728 0.642 . . . . 0.0 111.107 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.7 t -73.31 -44.61 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 0.0 109.98 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.43 -38.07 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 113.731 -1.577 . . . . 0.0 109.169 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.19 -38.48 82.06 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.772 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -66.67 -49.69 65.34 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.448 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -70.82 -39.3 73.11 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.031 0.532 . . . . 0.0 110.113 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.96 -23.91 67.36 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.081 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -99.23 -44.49 6.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 123.332 0.395 . . . . 0.0 111.425 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.9 t -82.14 -26.73 33.25 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.457 1.103 . . . . 0.0 111.204 -173.219 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -135.37 61.7 45.96 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 122.707 0.403 . . . . 0.0 111.49 -175.199 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.37 -24.54 12.16 Favored 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 121.272 1.315 . . . . 0.0 110.274 162.806 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -124.48 98.46 5.75 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.401 1.48 . . . . 0.0 107.371 171.38 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.7 p . . . . . 0 CA--C 1.549 0.917 0 C-N-CA 124.41 1.084 . . . . 0.0 109.387 175.038 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.4 m80 . . . . . 0 N--CA 1.483 1.212 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.6 ttt -158.25 138.75 12.71 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 123.743 0.817 . . . . 0.0 109.678 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -153.96 27.42 0.48 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.995 0.918 . . . . 0.0 109.194 174.448 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.453 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 6.6 p-10 -149.68 98.86 2.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.035 -170.321 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -76.97 119.74 21.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.618 -1.628 . . . . 0.0 109.663 174.83 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -105.03 149.18 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.777 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 1.4 t -83.6 163.39 20.39 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.611 0.72 . . . . 0.0 110.283 176.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 31.5 tt0 -58.4 -32.76 68.93 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.523 -1.671 . . . . 0.0 111.217 -176.898 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -138.4 -49.52 0.55 Allowed 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.097 0.559 . . . . 0.0 109.978 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.2 p -124.84 72.18 1.21 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.605 -169.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.777 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -141.65 135.09 29.59 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.983 150.495 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -69.19 -58.94 3.39 Favored 'General case' 0 CA--C 1.555 1.145 0 O-C-N 124.241 0.963 . . . . 0.0 109.483 168.575 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . -172.99 133.4 0.54 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 123.567 0.747 . . . . 0.0 111.083 170.483 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -114.35 130.75 56.69 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -80.29 3.73 20.02 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 118.44 0.564 . . . . 0.0 111.738 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 16.7 t -137.4 134.88 36.42 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.138 0.975 . . . . 0.0 109.827 178.13 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.4 p -69.14 -28.83 66.8 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.832 0.853 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 31' ' ' VAL . 67.9 t60 -62.97 -44.29 96.46 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.176 0.59 . . . . 0.0 110.252 176.213 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -53.7 -51.28 63.78 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.119 0.968 . . . . 0.0 111.464 177.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.8 tp -67.7 -34.86 77.72 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.287 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.43 88.26 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.056 0.543 . . . . 0.0 111.004 176.51 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.664 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 61.8 t -65.17 -36.67 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.553 175.681 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -65.28 -40.98 94.58 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.026 0.93 . . . . 0.0 110.75 174.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.472 ' HG2' ' HB2' ' A' ' 36' ' ' HIS . 17.2 ttt180 -75.08 9.74 1.83 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 123.907 0.883 . . . . 0.0 111.505 -174.441 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.538 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 25.7 ptt? -49.68 -27.47 4.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.307 1.443 . . . . 0.0 113.705 169.037 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.412 HG22 ' H ' ' A' ' 35' ' ' ILE . 3.8 tp -86.82 -29.15 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.225 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.472 ' HB2' ' HG2' ' A' ' 33' ' ' ARG . 58.0 m-70 -99.9 -60.24 1.57 Allowed 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -167.7 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -104.35 24.99 10.7 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -149.736 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.95 43.26 34.68 Favored Glycine 0 N--CA 1.478 1.497 0 C-N-CA 119.872 -1.156 . . . . 0.0 113.496 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 34' ' ' MET . 11.1 mm-40 -146.75 114.99 6.64 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 124.592 1.157 . . . . 0.0 108.229 -166.264 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -112.4 94.0 25.2 Favored Pre-proline 0 N--CA 1.472 0.665 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 167.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.664 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 28.3 Cg_endo -58.32 -67.21 0.06 OUTLIER 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 123.543 2.829 . . . . 0.0 112.188 -174.092 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 54' ' ' LYS . 86.3 mt -146.23 90.88 2.0 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -136.48 135.6 38.72 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.794 0.437 . . . . 0.0 111.904 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.515 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 7.5 t -71.58 105.35 3.61 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.698 1.199 . . . . 0.0 109.725 171.435 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -93.27 49.49 1.41 Allowed 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.574 1.178 . . . . 0.0 110.185 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 3.1 mp -114.57 -55.31 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 169.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 21.3 p -112.7 -113.03 0.33 Allowed 'General case' 0 C--O 1.238 0.462 0 N-CA-C 103.997 -2.594 . . . . 0.0 103.997 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -148.32 154.63 25.98 Favored Glycine 0 C--N 1.313 -0.742 0 N-CA-C 108.626 -1.79 . . . . 0.0 108.626 152.972 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.9 t80 172.48 114.37 0.01 OUTLIER 'General case' 0 C--N 1.351 0.662 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -173.802 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.1 m -129.4 138.31 51.42 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 52' ' ' ARG . 52.0 t -136.36 167.13 21.91 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.131 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.418 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 16.8 tpp85 -70.44 -33.82 71.75 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.239 176.384 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -121.43 134.04 55.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.376 0.67 . . . . 0.0 109.918 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.516 ' HB2' HD22 ' A' ' 42' ' ' LEU . 5.5 ttpm? -59.29 -21.76 60.16 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.495 0.718 . . . . 0.0 111.374 174.979 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.98 -28.13 15.74 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.647 1.179 . . . . 0.0 112.582 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -77.52 -55.0 5.74 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.27 0.628 . . . . 0.0 112.358 175.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.575 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -75.86 -34.55 60.04 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -171.85 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 61' ' ' MET . 1.3 p-10 -55.51 -37.48 67.95 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.506 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 45.8 p-90 -86.04 -35.85 20.07 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 118.251 0.478 . . . . 0.0 111.02 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 65.8 t60 -48.26 -32.23 6.98 Favored 'General case' 0 CA--C 1.572 1.822 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 171.152 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.449 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 23.8 ptp -69.48 -32.19 70.94 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.935 -1.103 . . . . 0.0 112.35 170.612 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 39.3 ttmt -58.11 -29.17 65.28 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 122.921 0.488 . . . . 0.0 111.457 169.507 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 31.2 mmmt -63.61 -38.09 89.8 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.916 0.486 . . . . 0.0 110.61 175.53 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.3 m-70 -71.61 -24.31 61.86 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.116 0.567 . . . . 0.0 110.281 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -84.15 -23.86 30.45 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.016 0.926 . . . . 0.0 109.057 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.18 -4.65 18.59 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.239 1.016 . . . . 0.0 111.529 -169.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -105.98 -18.02 14.17 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 175.421 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.2 m -90.99 -69.01 0.76 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.686 0.395 . . . . 0.0 110.906 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -136.99 -44.26 0.57 Allowed 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -174.064 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -89.47 65.52 7.09 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -176.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -54.05 -55.6 25.95 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.302 1.441 . . . . 0.0 111.908 -169.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.428 ' O ' ' HA ' ' A' ' 80' ' ' LYS . 80.6 m-85 -139.98 137.83 35.02 Favored 'General case' 0 CA--C 1.523 -0.072 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.0 m -120.28 138.67 53.55 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 124.952 1.301 . . . . 0.0 109.339 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 9.8 t -87.19 105.63 17.33 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.831 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -58.74 -8.79 1.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.515 HD11 HG13 ' A' ' 98' ' ' VAL . 8.4 mt -93.9 -48.05 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 123.553 0.741 . . . . 0.0 112.156 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 15.9 p -132.06 5.39 4.17 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.35 34.83 59.79 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 123.563 0.601 . . . . 0.0 114.366 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.438 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 8.1 tmtm? -65.21 -28.86 69.66 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.063 0.545 . . . . 0.0 111.712 -174.181 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 72' ' ' PHE . 75.4 mmtt 71.08 116.62 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.658 1.183 . . . . 0.0 110.872 172.952 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.414 ' CZ ' ' HD2' ' A' ' 79' ' ' LYS . 89.5 m-85 -127.46 160.34 31.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.623 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.47 -40.14 95.14 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.91 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -136.59 154.59 50.64 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 123.277 0.631 . . . . 0.0 109.981 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -59.93 -31.19 69.62 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.347 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.55 -45.16 81.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.62 0.768 . . . . 0.0 110.714 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.5 m -67.87 -30.82 70.29 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 123.77 0.669 . . . . 0.0 111.776 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.29 -48.53 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 C-N-CA 123.431 0.692 . . . . 0.0 110.425 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.0 t -73.68 -35.07 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 109.657 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.36 95.42 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.282 173.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -72.81 -34.74 67.07 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.689 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -73.78 -36.81 65.1 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.316 0.647 . . . . 0.0 109.823 -176.368 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.38 -38.54 89.98 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.033 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -97.01 -46.85 6.03 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -169.462 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.3 t -80.28 -20.74 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.633 0.773 . . . . 0.0 110.673 -173.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -138.28 68.35 47.28 Favored Pre-proline 0 CA--C 1.561 1.399 0 C-N-CA 123.147 0.579 . . . . 0.0 109.532 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -44.21 -35.5 8.04 Favored 'Trans proline' 0 C--N 1.39 2.75 0 C-N-CA 123.685 2.924 . . . . 0.0 113.831 170.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -108.63 97.91 7.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 172.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.515 HG13 HD11 ' A' ' 76' ' ' ILE . 65.4 t . . . . . 0 C--O 1.255 1.344 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.417 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 120.974 0.416 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.47 ' HG3' ' HG2' ' A' ' 12' ' ' ARG . 20.0 ptp -168.37 -47.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.1 0.96 . . . . 0.0 109.638 173.68 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.47 ' HG2' ' HG3' ' A' ' 11' ' ' MET . 21.2 ptt180 -152.79 29.45 0.52 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.157 0.983 . . . . 0.0 108.716 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -143.54 94.82 2.65 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.746 1.26 . . . . 0.0 108.786 -166.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -99.84 133.52 44.08 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 113.516 -1.675 . . . . 0.0 109.57 -174.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 17' ' ' GLU . 6.7 mm -115.18 149.49 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.603 0.761 . . . . 0.0 109.582 -166.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.62 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.8 t -85.49 -20.39 29.79 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.531 0.732 . . . . 0.0 109.979 174.064 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.703 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.7 tt0 85.95 -3.97 0.79 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 126.235 1.814 . . . . 0.0 111.19 171.095 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -135.87 -49.2 0.69 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -136.21 77.14 1.64 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.357 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.62 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -170.85 128.04 0.75 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.605 1.162 . . . . 0.0 109.394 163.354 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.418 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 34.1 ptt180 -68.86 -58.25 4.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.159 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.418 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -173.2 152.85 2.34 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 124.135 0.974 . . . . 0.0 109.616 164.48 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -125.94 152.05 46.15 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.558 1.143 . . . . 0.0 108.29 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -59.03 -30.31 67.93 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 m -143.21 156.11 44.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.269 0.628 . . . . 0.0 110.98 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.577 ' HA ' HD23 ' A' ' 29' ' ' LEU . 41.9 m -57.11 -36.52 70.73 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.608 171.726 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -74.13 -35.41 64.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.087 0.555 . . . . 0.0 110.732 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.78 -47.21 86.59 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.405 0.682 . . . . 0.0 110.467 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.577 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.2 OUTLIER -66.98 -28.99 68.71 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.828 0.851 . . . . 0.0 110.747 174.232 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.71 -27.52 69.27 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.936 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.11 -41.45 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 122.749 0.42 . . . . 0.0 110.212 173.688 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -64.92 -38.45 91.01 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.703 0.801 . . . . 0.0 110.222 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.48 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 24.9 ttt85 -70.03 5.95 1.42 Allowed 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 124.859 1.263 . . . . 0.0 111.723 -176.115 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.0 ptm -46.11 -18.4 0.05 Allowed 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 125.314 1.446 . . . . 0.0 113.574 171.192 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.98 -52.88 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.919 0 C-N-CA 125.403 1.481 . . . . 0.0 110.428 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.48 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -100.42 6.45 44.42 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.535 0.734 . . . . 0.0 112.65 -172.861 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.421 HG21 ' HA ' ' A' ' 40' ' ' LYS . 3.4 t -58.88 -55.4 35.58 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -163.052 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.08 -31.41 3.13 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-O 120.083 -0.287 . . . . 0.0 112.62 -171.811 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -86.75 -48.54 8.16 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.883 0.873 . . . . 0.0 110.886 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' HG21 ' A' ' 37' ' ' THR . 60.5 mttp 70.3 122.75 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 126.107 1.763 . . . . 0.0 111.429 -168.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.27 -170.84 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.217 0 C-N-CA 121.979 1.786 . . . . 0.0 110.679 164.388 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 54' ' ' LYS . 95.4 mt -92.38 98.22 11.35 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -122.46 130.15 52.77 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.389 1.076 . . . . 0.0 110.134 -167.013 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.463 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 21.1 t -69.0 107.05 2.98 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.33 170.103 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.49 27.28 0.44 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.581 1.152 . . . . 0.0 111.693 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.463 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 21.8 mm -118.82 -3.31 9.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.479 1.112 . . . . 0.0 108.773 -168.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.4 p 179.93 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.523 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 -169.029 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.26 135.47 5.24 Favored Glycine 0 C--N 1.309 -0.918 0 N-CA-C 107.142 -2.383 . . . . 0.0 107.142 158.356 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -179.36 111.86 0.05 Allowed 'General case' 0 C--N 1.346 0.431 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.2 m -128.71 146.52 50.86 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -166.859 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 t -157.48 179.04 9.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.595 -177.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -110.52 -3.43 16.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.409 0.684 . . . . 0.0 110.149 169.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -106.02 104.64 14.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 172.44 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.5 pttt -57.64 -33.54 68.39 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.622 0.769 . . . . 0.0 112.801 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.41 -41.73 69.63 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.758 0.823 . . . . 0.0 112.097 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.3 m -52.08 -52.87 48.46 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.088 0.955 . . . . 0.0 112.616 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.466 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.3 OUTLIER -77.85 -31.49 51.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.607 0.763 . . . . 0.0 111.995 177.77 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.69 -44.0 97.06 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.575 0.75 . . . . 0.0 112.968 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -81.03 -36.84 30.04 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -51.57 -30.72 21.88 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.456 1.102 . . . . 0.0 113.683 165.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.435 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 28.5 ttt -71.6 -39.57 70.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.102 0.561 . . . . 0.0 111.357 173.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -58.77 -34.43 71.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.273 0.629 . . . . 0.0 110.654 168.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -64.19 -29.42 70.53 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.628 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 82.7 m-70 -70.75 -11.6 61.05 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.882 -0.511 . . . . 0.0 111.794 172.815 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -102.42 -17.85 15.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.013 0.925 . . . . 0.0 108.586 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.65 -44.51 6.75 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.954 0.902 . . . . 0.0 110.645 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.651 ' HA ' ' HG2' ' A' ' 71' ' ' GLN . 8.1 m-20 -74.05 1.56 10.76 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 21.9 t -79.9 -64.24 1.23 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.513 0.725 . . . . 0.0 109.867 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -136.78 -29.31 0.94 Allowed 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.696 0.799 . . . . 0.0 111.868 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -115.79 68.64 0.72 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.116 0.566 . . . . 0.0 109.829 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.651 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 44.1 mt-30 -76.6 -10.35 59.32 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.185 -172.014 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -118.11 156.59 28.4 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 58.1 p -157.58 123.82 4.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 124.467 1.107 . . . . 0.0 108.562 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.9 t -70.69 114.03 8.37 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 169.008 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -60.12 -13.89 14.24 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -172.918 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mt -104.38 -31.41 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -175.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 19.4 p -136.2 -4.95 2.11 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.765 -1.209 . . . . 0.0 113.389 -178.001 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.05 33.75 85.26 Favored Glycine 0 C--N 1.347 1.185 0 C-N-CA 123.039 0.352 . . . . 0.0 113.381 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.541 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.0 tmtt? -65.76 -35.13 79.85 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.03 0.932 . . . . 0.0 112.103 -176.343 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? 73.67 120.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.816 1.246 . . . . 0.0 110.4 -176.625 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -128.56 162.42 27.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.913 0.885 . . . . 0.0 109.861 175.203 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 8.1 mm-40 -70.69 -28.3 64.66 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.437 0.695 . . . . 0.0 112.673 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HD3' ' HB2' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -144.39 151.22 38.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.122 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -66.2 -25.1 66.77 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.632 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.65 -28.29 65.76 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 49.4 m -67.48 -31.7 72.03 Favored 'General case' 0 C--N 1.359 1.012 0 O-C-N 122.952 0.157 . . . . 0.0 110.923 171.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.4 t -75.15 -47.69 34.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.002 0.921 . . . . 0.0 110.196 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 70.6 t -73.34 -35.94 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.081 1.352 . . . . 0.0 109.959 -174.36 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.89 95.33 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.951 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 90' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 86' ' ' SER . 2.3 t60 -71.41 -30.18 65.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.873 178.819 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.6 -41.0 69.47 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.412 1.085 . . . . 0.0 109.603 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.36 64.36 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.125 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -105.58 -42.03 5.31 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.219 0.608 . . . . 0.0 112.34 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.8 t -93.26 -23.08 18.64 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.096 0.958 . . . . 0.0 111.306 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.435 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 53.7 m-70 -131.86 43.49 1.11 Allowed Pre-proline 0 CA--C 1.57 1.732 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.057 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.435 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 37.7 Cg_exo -60.95 -34.48 90.86 Favored 'Trans proline' 0 C--N 1.395 2.975 0 CA-C-N 122.083 1.78 . . . . 0.0 112.087 171.854 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -113.83 97.6 6.5 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 124.606 1.162 . . . . 0.0 108.691 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 C--O 1.256 1.413 0 C-N-CA 124.313 1.045 . . . . 0.0 109.207 173.654 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 46.1 ttm -155.35 -66.55 0.12 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.841 0.456 . . . . 0.0 110.527 -177.628 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.4 ttt-85 -107.21 32.24 4.78 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 122.563 1.173 . . . . 0.0 108.542 -178.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -164.71 114.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -168.374 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -121.54 120.62 35.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.792 0.837 . . . . 0.0 110.715 -178.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 43.0 mm -100.95 110.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.097 -177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.7 t -61.97 90.82 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 158.473 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 18.47 -59.44 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 129.101 2.96 . . . . 0.0 116.563 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -121.35 -39.28 2.69 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.474 -165.046 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.25 -23.36 19.35 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.77 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.32 125.88 35.3 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -170.829 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.432 ' CD ' ' H ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -69.62 -52.01 29.77 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.029 163.374 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -177.43 138.17 0.22 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 125.24 1.416 . . . . 0.0 108.568 160.555 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -105.02 151.81 23.5 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -63.29 -34.71 78.27 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.309 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 m -146.95 154.44 41.27 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 121.124 0.488 . . . . 0.0 111.817 -169.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 p -61.03 -45.31 95.3 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.72 1.208 . . . . 0.0 112.142 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -68.78 -35.63 77.29 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.26 -51.69 67.2 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.505 0.722 . . . . 0.0 111.106 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -37.11 85.12 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.984 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.06 -29.23 68.41 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 124.137 0.898 . . . . 0.0 112.532 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.99 -45.21 95.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.219 0.608 . . . . 0.0 110.972 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -35.83 70.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.333 0.653 . . . . 0.0 109.479 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.644 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 39.1 ttt85 -61.96 -8.08 4.68 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.348 1.459 . . . . 0.0 112.361 -175.827 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.41 ' HA ' ' HB ' ' A' ' 37' ' ' THR . 23.0 ptm -46.04 -12.55 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 -178.159 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -53.42 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 C-N-CA 124.587 1.155 . . . . 0.0 108.641 172.846 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.548 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -101.82 14.37 32.14 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.399 1.479 . . . . 0.0 112.435 -176.161 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.644 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 13.5 t -57.89 -70.47 0.13 Allowed 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -154.284 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.03 32.86 81.8 Favored Glycine 0 N--CA 1.479 1.541 0 CA-C-N 118.994 0.815 . . . . 0.0 111.099 -169.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.446 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 10.6 mm-40 -147.5 -42.31 0.17 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.517 1.927 . . . . 0.0 106.913 -172.777 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? 61.5 96.67 0.04 OUTLIER Pre-proline 0 C--N 1.356 0.878 0 C-N-CA 126.067 1.747 . . . . 0.0 112.245 174.019 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.07 -173.23 1.6 Allowed 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.4 2.067 . . . . 0.0 110.185 161.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -120.3 118.47 30.49 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.802 0.441 . . . . 0.0 110.064 -175.519 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -116.06 148.78 39.85 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.577 0.751 . . . . 0.0 109.664 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.8 t -66.37 107.74 2.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.475 0.71 . . . . 0.0 109.962 167.285 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -75.91 8.71 2.89 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.646 0.779 . . . . 0.0 112.893 -178.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.464 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 39.2 mm -88.77 -56.24 5.44 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.653 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.505 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.3 p -119.44 -107.76 0.37 Allowed 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 104.139 -2.541 . . . . 0.0 104.139 175.155 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.505 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.16 164.18 29.24 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 160.097 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.0 t80 167.47 112.61 0.01 OUTLIER 'General case' 0 C--N 1.353 0.725 0 N-CA-C 103.379 -2.822 . . . . 0.0 103.379 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m -117.1 135.31 53.84 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.577 0.703 . . . . 0.0 109.765 -165.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.4 t -151.89 164.4 37.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.837 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -81.57 -31.14 32.74 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.069 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -103.99 127.18 51.54 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.372 1.069 . . . . 0.0 109.487 -173.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -55.86 -30.21 61.14 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.723 0.639 . . . . 0.0 112.029 175.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.52 83.44 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.397 1.079 . . . . 0.0 112.901 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -59.97 -54.36 46.94 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.343 0.657 . . . . 0.0 111.674 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.5 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.5 OUTLIER -75.43 -24.11 57.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 123.744 0.818 . . . . 0.0 112.013 177.605 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -52.0 -42.98 63.43 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.553 0.741 . . . . 0.0 112.751 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -79.67 -48.37 13.81 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 83.2 t60 -48.52 -39.98 25.2 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.157 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.418 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 0.0 OUTLIER -71.01 -37.53 72.63 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 119.991 1.268 . . . . 0.0 110.551 175.861 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -65.24 -26.35 68.07 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.532 0.733 . . . . 0.0 111.496 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -35.54 79.44 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 94.6 m-70 -68.37 -16.98 64.12 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.136 0.574 . . . . 0.0 111.659 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -81.19 -25.17 36.97 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.278 0.631 . . . . 0.0 109.648 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.37 -33.46 7.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.738 0.815 . . . . 0.0 111.716 -170.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -67.45 -22.11 65.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -158.092 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 m -66.96 -53.5 31.01 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.825 0.85 . . . . 0.0 111.765 -173.607 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -135.95 -44.39 0.65 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.084 0.553 . . . . 0.0 110.377 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -98.59 58.33 1.21 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.658 0.783 . . . . 0.0 109.503 -172.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -61.43 -14.34 27.55 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.153 0.981 . . . . 0.0 111.759 -168.854 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -134.85 141.06 46.28 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 125.045 1.338 . . . . 0.0 107.922 175.037 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.544 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 68.8 p -128.65 168.97 15.02 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 124.9 1.28 . . . . 0.0 109.892 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 37.2 t -123.6 97.31 5.32 Favored 'General case' 0 C--O 1.2 -1.534 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -56.72 -14.83 3.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -169.245 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 mt -87.35 -22.87 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.749 0.419 . . . . 0.0 111.474 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.642 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.4 p -147.56 4.14 0.77 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 53.09 37.02 53.45 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.161 0.886 . . . . 0.0 114.72 -177.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.1 tmtt? -66.3 -37.91 86.5 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 111.646 -172.228 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 71.5 mmtt 72.25 117.02 0.05 OUTLIER 'General case' 0 C--N 1.362 1.15 0 C-N-CA 124.797 1.239 . . . . 0.0 110.11 176.751 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.413 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.6 m-85 -125.31 164.99 19.17 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.57 -39.51 94.57 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 114.408 -1.269 . . . . 0.0 111.54 176.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -145.8 155.83 43.18 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.021 0.528 . . . . 0.0 110.023 -177.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.9 pptp? -64.34 -24.42 67.64 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.102 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.52 -47.1 80.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.062 0.545 . . . . 0.0 110.484 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -65.81 -30.77 71.45 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.423 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 86.5 t -72.92 -49.26 40.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.714 0.805 . . . . 0.0 110.194 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.78 -35.37 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.963 1.305 . . . . 0.0 109.182 -174.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.52 -44.41 94.32 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.517 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.05 -35.0 66.62 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.42 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -69.83 -38.81 76.65 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.277 1.031 . . . . 0.0 109.244 -172.021 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.24 -23.07 66.35 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.459 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -91.94 -50.82 5.51 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 121.197 0.522 . . . . 0.0 110.423 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.7 t -85.12 -23.92 28.24 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.825 1.25 . . . . 0.0 111.795 -169.14 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.7 m-70 -132.34 59.52 44.41 Favored Pre-proline 0 CA--C 1.562 1.439 0 C-N-CA 122.557 0.343 . . . . 0.0 111.715 -172.779 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.1 -31.71 11.79 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 121.855 1.704 . . . . 0.0 111.045 170.167 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -128.95 98.14 4.85 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.965 1.306 . . . . 0.0 107.836 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 89.2 t . . . . . 0 C--O 1.249 1.05 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.298 178.514 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.2 t-160 . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -91.93 23.88 3.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.716 0.807 . . . . 0.0 112.48 -170.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -143.85 131.99 21.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.135 0.974 . . . . 0.0 108.377 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 59.85 95.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.117 1.367 . . . . 0.0 111.707 -177.646 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.27 113.11 24.69 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -177.582 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.4 mm -105.54 157.05 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.22 0.608 . . . . 0.0 109.576 -167.334 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.622 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 23.4 t -90.85 12.21 20.12 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.679 0.391 . . . . 0.0 111.205 173.396 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 87.54 -38.88 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.761 1.624 . . . . 0.0 110.08 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -137.41 -55.26 0.69 Allowed 'General case' 0 C--N 1.351 0.664 0 C-N-CA 122.73 0.412 . . . . 0.0 110.028 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 p -94.82 58.86 2.31 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.622 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.14 142.24 4.94 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.003 0.921 . . . . 0.0 110.46 160.724 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 10.2 ptp180 -68.0 -58.55 4.34 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 118.982 -0.532 . . . . 0.0 109.621 167.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.419 ' N ' ' HG3' ' A' ' 21' ' ' ARG . . . 174.28 134.87 0.04 OUTLIER 'General case' 0 C--N 1.358 0.961 0 C-N-CA 125.738 1.615 . . . . 0.0 108.0 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -108.46 164.52 12.27 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -56.4 -44.53 80.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.934 1.294 . . . . 0.0 111.339 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.0 m -146.21 168.59 20.65 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.301 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.528 ' HA ' HD23 ' A' ' 29' ' ' LEU . 51.0 p -64.62 -39.24 93.37 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.275 1.03 . . . . 0.0 112.617 -176.967 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -75.13 -37.0 61.57 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.395 0.678 . . . . 0.0 110.909 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.49 -41.93 73.71 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.911 0.885 . . . . 0.0 110.581 167.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -72.8 -33.81 66.48 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.899 178.236 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.628 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -62.75 -28.23 69.83 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.336 1.055 . . . . 0.0 111.9 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.2 t -50.29 -46.65 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 123.834 0.709 . . . . 0.0 111.49 168.593 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -77.06 -45.66 26.34 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.349 171.37 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.628 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 56.8 ttt180 -79.04 40.21 0.4 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.289 1.435 . . . . 0.0 110.155 -170.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -60.7 -52.77 63.69 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 123.824 0.85 . . . . 0.0 112.405 -162.155 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.2 tp -85.16 -17.89 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.581 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 49.3 m-70 -84.33 -42.3 15.91 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 120.613 1.552 . . . . 0.0 109.734 -156.7 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.3 t -70.9 -27.36 63.74 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 114.768 -1.106 . . . . 0.0 113.405 -165.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.58 33.88 12.69 Favored Glycine 0 C--N 1.342 0.874 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.183 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -110.83 -30.56 7.5 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.285 1.034 . . . . 0.0 109.98 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.9 pttt 44.55 72.84 1.09 Allowed Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 126.323 1.849 . . . . 0.0 112.572 -171.268 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.72 147.41 94.75 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.508 2.139 . . . . 0.0 111.581 175.41 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 50' ' ' THR . 91.2 mt -80.64 137.12 36.32 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -171.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.456 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 61.7 tt0 -117.65 139.3 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -168.254 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.715 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 1.8 t -64.28 112.79 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.936 0.894 . . . . 0.0 110.79 173.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -82.02 26.63 0.51 Allowed 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.689 0.796 . . . . 0.0 112.773 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 25.7 mm -105.64 -53.17 7.02 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 169.34 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.542 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 27.3 p -118.5 -109.33 0.36 Allowed 'General case' 0 C--N 1.346 0.443 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 173.864 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.542 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.02 165.92 29.35 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 108.624 -1.79 . . . . 0.0 108.624 155.13 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.688 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 23.8 t80 175.61 111.7 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -105.64 125.58 51.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -171.996 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.5 t -143.13 165.8 26.42 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.343 0.657 . . . . 0.0 111.622 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -70.18 -42.72 72.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.903 1.281 . . . . 0.0 110.835 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -110.98 131.37 55.1 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.548 0.739 . . . . 0.0 110.525 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -50.86 -37.26 42.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.793 1.237 . . . . 0.0 111.447 172.721 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -36.95 52.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.254 1.022 . . . . 0.0 112.515 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.8 m -69.47 -55.97 8.74 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.451 0.301 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -41.82 45.03 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -173.126 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -50.25 -54.18 22.99 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.769 0.827 . . . . 0.0 111.77 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.536 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 58.6 m95 -78.27 -33.92 49.28 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.331 -172.848 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -45.1 -41.17 7.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 124.049 0.843 . . . . 0.0 112.617 163.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.715 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 33.6 mtm -61.85 -48.01 82.49 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 117.465 0.121 . . . . 0.0 110.892 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.79 -39.54 77.77 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.102 0.876 . . . . 0.0 111.014 176.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 31.4 mmmt -59.42 -45.73 90.71 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 124.208 0.943 . . . . 0.0 110.221 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.06 9.61 28.36 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -172.226 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.8 -33.49 64.45 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.3 0.64 . . . . 0.0 111.118 171.83 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.65 -32.09 11.25 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 73.25 18.29 3.8 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 125.579 1.552 . . . . 0.0 110.303 -174.704 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.7 t -59.95 -26.88 66.34 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.573 0.749 . . . . 0.0 111.717 -170.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.511 ' HB3' ' HG2' ' A' ' 71' ' ' GLN . 97.4 m-85 -69.55 -46.63 65.97 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.441 0.696 . . . . 0.0 111.819 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 45.04 35.77 1.73 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 123.998 0.919 . . . . 0.0 112.383 -172.295 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.511 ' HG2' ' HB3' ' A' ' 69' ' ' PHE . 25.7 mm-40 -84.74 -5.51 59.32 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -167.489 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -140.31 132.57 28.22 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 32.6 p -156.94 165.89 34.9 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 125.154 1.382 . . . . 0.0 109.215 175.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.0 t -86.91 124.29 32.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -62.68 -25.86 68.36 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.987 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -92.44 -42.99 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.013 0.525 . . . . 0.0 112.221 -172.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.14 8.4 2.94 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 119.628 1.104 . . . . 0.0 113.142 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.4 37.43 18.71 Favored Glycine 0 N--CA 1.483 1.797 0 N-CA-C 117.769 1.868 . . . . 0.0 117.769 165.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -68.54 -26.98 65.7 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.855 0.827 . . . . 0.0 113.047 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.0 OUTLIER 77.61 121.36 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.667 1.587 . . . . 0.0 110.263 -172.335 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -119.32 170.19 9.33 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.945 0.898 . . . . 0.0 110.554 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.688 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 1.7 mm-40 -68.93 -28.64 66.83 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.799 -175.141 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -162.58 165.77 25.54 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.935 0.894 . . . . 0.0 109.31 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -60.65 -37.39 81.38 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.106 0.962 . . . . 0.0 111.009 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.85 -37.85 88.91 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.195 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.5 m -66.01 -29.97 70.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.966 0.506 . . . . 0.0 111.146 177.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 75.8 t -73.68 -48.58 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.268 1.027 . . . . 0.0 110.237 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.0 t -73.61 -34.48 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.874 -175.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.2 86.35 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.27 174.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -72.46 -32.65 66.43 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.346 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -70.23 -36.68 74.68 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.255 1.022 . . . . 0.0 109.362 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.36 83.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.749 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -87.97 -47.76 8.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.386 -171.362 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.6 t -104.13 -6.23 21.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.994 0.917 . . . . 0.0 111.763 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -135.29 50.75 4.89 Favored Pre-proline 0 CA--C 1.57 1.736 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.687 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.47 -51.69 10.63 Favored 'Trans proline' 0 C--N 1.397 3.129 0 C-N-CA 122.606 2.204 . . . . 0.0 112.395 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -141.88 96.23 2.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 171.744 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.251 1.159 0 C-N-CA 123.468 0.707 . . . . 0.0 110.032 176.865 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.5 m80 . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.8 ptm -134.42 -3.6 2.68 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.834 0.854 . . . . 0.0 110.721 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.76 63.31 7.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.799 0.809 . . . . 0.0 109.158 175.826 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -148.53 95.5 2.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.8 1.24 . . . . 0.0 107.747 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -93.92 102.58 14.68 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.419 -178.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.0 mm -101.75 104.83 16.94 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.605 -166.505 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 18' ' ' TYR . 7.6 t -60.04 92.95 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 160.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 32.23 -62.23 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 128.772 2.829 . . . . 0.0 115.502 166.771 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 16' ' ' CYS . 3.2 t80 -134.67 -41.9 0.77 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.616 0.767 . . . . 0.0 110.155 -175.663 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -97.79 34.59 1.85 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.181 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.37 122.54 26.52 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.783 0.433 . . . . 0.0 111.126 159.267 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -69.37 -53.01 21.67 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 168.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -174.69 125.8 0.29 Allowed 'General case' 0 C--N 1.362 1.141 0 C-N-CA 123.926 0.89 . . . . 0.0 109.868 163.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -96.82 146.49 24.87 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -67.05 -29.81 69.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.946 0.499 . . . . 0.0 111.164 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -162.59 158.21 23.07 Favored 'General case' 0 CA--C 1.557 1.241 0 CA-C-O 120.993 0.425 . . . . 0.0 111.158 -173.426 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.8 p -65.25 -31.06 72.02 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -74.42 -36.7 63.46 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.359 0.527 . . . . 0.0 111.043 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -58.72 -48.29 81.65 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.697 1.237 . . . . 0.0 109.606 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.23 -43.53 78.7 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.801 -2.0 . . . . 0.0 112.383 169.86 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -57.9 -29.42 65.07 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.801 0.84 . . . . 0.0 112.679 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 50' ' ' THR . 61.1 t -61.05 -46.82 95.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.488 0.715 . . . . 0.0 110.532 176.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -73.81 -39.61 63.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.86 0.864 . . . . 0.0 111.069 174.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.408 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 43.0 ttt180 -69.35 -1.93 9.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.685 1.194 . . . . 0.0 111.965 -173.562 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.543 ' SD ' ' NE2' ' A' ' 43' ' ' GLN . 24.9 ptt? -45.38 -16.5 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.985 1.714 . . . . 0.0 114.79 174.156 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -86.77 -56.89 4.75 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.706 0 C-N-CA 125.379 1.471 . . . . 0.0 110.046 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.83 6.43 36.59 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -172.003 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.66 HG21 ' HD3' ' A' ' 41' ' ' PRO . 5.2 t -62.15 -49.66 74.97 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -169.212 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.28 -30.33 3.71 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 119.917 -0.38 . . . . 0.0 112.735 -169.885 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -70.03 -16.47 63.16 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.087 0.955 . . . . 0.0 113.217 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.08 82.14 0.24 Allowed Pre-proline 0 CA--C 1.563 1.476 0 C-N-CA 125.279 1.431 . . . . 0.0 112.706 -176.745 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PRO . . . . . 0.66 ' HD3' HG21 ' A' ' 37' ' ' THR . 2.1 Cg_endo -83.3 173.58 9.7 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.292 2.661 . . . . 0.0 110.482 172.291 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 mp -97.92 131.37 44.44 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -173.669 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' SD ' ' A' ' 34' ' ' MET . 33.4 tt0 -120.32 141.42 50.04 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.733 0.413 . . . . 0.0 110.503 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.7 t -64.65 108.53 1.73 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.645 0.778 . . . . 0.0 109.573 169.724 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.83 6.28 2.66 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.32 1.048 . . . . 0.0 112.644 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.594 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 mp -90.73 -51.59 11.6 Favored 'Isoleucine or valine' 0 C--N 1.354 0.802 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -174.149 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 25.0 p -119.94 -112.75 0.33 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.36 158.27 27.66 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 108.253 -1.939 . . . . 0.0 108.253 157.026 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.7 t80 172.04 110.46 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 102.216 -3.253 . . . . 0.0 102.216 -175.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 31' ' ' VAL . 2.7 m -119.64 137.12 54.08 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -167.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 8.1 p -160.11 155.93 25.96 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.994 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 2.68 45.05 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.515 175.044 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -105.21 103.99 13.63 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 124.548 1.139 . . . . 0.0 108.345 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -50.73 -45.36 58.61 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.373 0.669 . . . . 0.0 111.268 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.65 -39.78 68.37 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.424 1.077 . . . . 0.0 112.783 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.499 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 22.9 t -61.47 -54.9 37.34 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.231 0.612 . . . . 0.0 111.79 -174.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.473 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.1 pt? -75.14 -35.91 61.63 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.793 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -50.66 -41.63 55.68 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.021 0.929 . . . . 0.0 112.733 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.433 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 93.7 m95 -80.67 -54.53 5.55 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.399 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -41.28 -46.63 3.26 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.4 ptm -61.52 -46.97 87.7 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -68.42 -36.58 79.28 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.489 0.661 . . . . 0.0 111.522 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 29.4 mmmt -67.05 -33.94 76.6 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.017 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 67' ' ' ASP . 0.2 OUTLIER -106.88 4.4 27.32 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 179.293 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.1 -43.36 87.47 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.28 15.06 30.0 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.509 175.05 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.513 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 6.0 p-10 33.59 46.19 0.11 Allowed 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 126.135 1.774 . . . . 0.0 114.172 -174.356 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.422 ' HA ' ' HB2' ' A' ' 73' ' ' SER . 19.9 m -62.59 -24.31 67.49 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.724 0.809 . . . . 0.0 113.132 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -93.7 -4.6 50.22 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.58 0.752 . . . . 0.0 112.383 178.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -65.21 -80.8 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -104.54 -85.97 0.46 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 166.258 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.509 ' HB2' ' O ' ' A' ' 81' ' ' PHE . 64.4 m-85 -159.45 134.49 8.13 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' SER . . . . . 0.422 ' HB2' ' HA ' ' A' ' 68' ' ' SER . 38.1 m -142.81 162.8 34.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.532 0.682 . . . . 0.0 111.446 -176.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 6.6 t -103.72 118.1 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 167.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.56 -22.81 66.73 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.047 0.385 . . . . 0.0 111.377 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mt -84.24 -41.73 16.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 122.78 0.432 . . . . 0.0 111.499 -172.403 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.7 p -136.92 -0.61 2.28 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.3 39.15 96.83 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 114.613 0.605 . . . . 0.0 114.613 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -64.49 -38.0 89.49 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.016 0.526 . . . . 0.0 111.212 -176.193 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 74.64 114.81 0.06 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.449 1.499 . . . . 0.0 110.014 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 72' ' ' PHE . 91.6 m-85 -122.19 163.63 19.23 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.302 0.641 . . . . 0.0 109.937 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.99 -1.4 52.47 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -158.62 144.67 16.89 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.671 0.788 . . . . 0.0 108.919 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HG3' ' HD1' ' A' ' 72' ' ' PHE . 57.5 mtpt -58.22 -27.52 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.459 1.104 . . . . 0.0 110.937 174.542 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -54.54 -44.7 73.06 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.544 0.738 . . . . 0.0 110.813 173.891 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -70.24 -29.04 65.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.509 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.27 -45.35 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 123.972 0.909 . . . . 0.0 110.494 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 88.5 t -71.44 -37.6 65.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.341 1.056 . . . . 0.0 109.147 -176.497 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.63 78.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.847 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -72.13 -33.89 68.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.449 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -73.59 -33.28 64.54 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.349 0.595 . . . . 0.0 109.482 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.58 71.54 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.016 174.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -87.96 -58.77 2.45 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-O 121.473 0.654 . . . . 0.0 111.448 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.5 t -91.78 -8.18 47.48 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.878 1.271 . . . . 0.0 111.554 -167.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -136.17 54.15 9.15 Favored Pre-proline 0 CA--C 1.564 1.514 0 C-N-CA 123.112 0.565 . . . . 0.0 111.084 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.99 -27.81 20.13 Favored 'Trans proline' 0 C--N 1.383 2.375 0 C-N-CA 121.978 1.786 . . . . 0.0 112.42 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -139.65 100.18 3.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.189 0.996 . . . . 0.0 109.161 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 77.0 t . . . . . 0 C--O 1.253 1.253 0 C-N-CA 123.959 0.904 . . . . 0.0 108.678 172.412 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.4 m80 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.1 91.63 0.07 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.021 0.826 . . . . 0.0 111.126 -176.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -169.23 48.02 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -127.15 89.38 2.96 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -174.167 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 63.0 m-85 -93.09 113.75 26.09 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.197 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.77 HG22 ' H ' ' A' ' 17' ' ' GLU . 9.5 mm -119.69 158.67 21.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 124.562 1.145 . . . . 0.0 108.491 -170.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.63 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.9 t -104.39 -10.03 18.04 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.828 0.851 . . . . 0.0 110.572 176.948 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.77 ' H ' HG22 ' A' ' 15' ' ' ILE . 3.1 mp0 88.65 -16.49 0.3 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.745 2.018 . . . . 0.0 112.391 170.131 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -134.86 -51.54 0.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.319 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.9 p -122.67 74.2 1.18 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.698 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.63 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -164.13 146.23 8.99 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.58 0.705 . . . . 0.0 112.229 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -77.9 -171.26 2.2 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 113.831 -1.531 . . . . 0.0 108.979 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.61 125.24 30.96 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.476 ' HB3' ' HB2' ' A' ' 28' ' ' ASN . 67.9 m-85 -110.23 147.54 33.58 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.058 0.543 . . . . 0.0 110.654 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -58.62 -37.22 75.43 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.119 0.968 . . . . 0.0 112.38 175.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.6 t -147.59 156.05 42.42 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.061 0.458 . . . . 0.0 111.103 -167.814 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.2 p -57.02 -27.08 61.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.662 -1.153 . . . . 0.0 111.551 171.282 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 36.7 t60 -70.99 -41.04 71.49 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.945 0.498 . . . . 0.0 110.625 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 2.3 m-20 -60.75 -49.62 76.78 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.021 0.915 . . . . 0.0 110.209 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 tp -63.83 -35.56 81.02 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.45 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.95 -31.98 71.52 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 123.444 0.697 . . . . 0.0 112.443 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.502 HG13 ' HB ' ' A' ' 50' ' ' THR . 79.0 t -64.08 -49.4 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.658 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -60.07 -39.18 85.17 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.773 0.829 . . . . 0.0 110.913 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -67.13 2.09 1.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.07 1.348 . . . . 0.0 111.73 -175.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.9 ptp -44.97 -22.95 0.11 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.58 1.552 . . . . 0.0 113.482 172.897 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.11 -50.59 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.772 1.229 . . . . 0.0 110.042 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -98.26 6.44 47.4 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.162 0.585 . . . . 0.0 111.638 -171.421 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -58.84 -60.19 4.23 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -164.59 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.48 -32.19 0.99 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 122.929 0.3 . . . . 0.0 113.335 -168.899 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.17 -42.83 75.37 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.749 1.219 . . . . 0.0 110.16 171.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 68.4 100.76 0.04 OUTLIER Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.729 1.611 . . . . 0.0 111.091 -171.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.87 -162.81 0.11 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.815 2.343 . . . . 0.0 111.603 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 54' ' ' LYS . 43.7 mt -100.01 106.34 18.11 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.221 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -132.33 135.51 46.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.539 0.736 . . . . 0.0 110.236 -169.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 1.2 t -65.32 107.79 1.73 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.108 0.963 . . . . 0.0 110.805 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -87.96 56.38 3.85 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.899 0.857 . . . . 0.0 110.811 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mm -125.93 -54.35 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 164.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.5 p -119.37 -116.99 0.32 Allowed 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 176.359 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -146.15 164.07 28.33 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 155.016 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 8.1 t80 171.25 113.1 0.01 OUTLIER 'General case' 0 C--N 1.348 0.511 0 N-CA-C 101.794 -3.41 . . . . 0.0 101.794 -174.204 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.502 ' HB ' HG13 ' A' ' 31' ' ' VAL . 8.0 m -121.75 129.5 52.74 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -170.206 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.6 t -141.01 163.12 33.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.637 -175.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -76.47 -21.04 56.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.493 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -117.76 116.23 26.6 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.483 1.113 . . . . 0.0 109.636 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.443 ' N ' HD13 ' A' ' 42' ' ' LEU . 63.4 tttm -57.61 -34.77 69.62 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.142 0.977 . . . . 0.0 111.801 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.65 70.97 Favored 'General case' 0 CA--C 1.554 1.122 0 O-C-N 123.846 0.716 . . . . 0.0 112.301 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -61.85 -55.27 31.63 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.745 0.418 . . . . 0.0 111.3 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -71.26 -27.93 63.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.133 0.573 . . . . 0.0 111.687 178.844 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -52.58 -44.12 65.72 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.721 0.808 . . . . 0.0 112.396 171.396 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -76.72 -45.83 27.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 63.8 t60 -45.94 -40.93 10.92 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 168.14 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.43 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 66.8 mtm -71.82 -37.4 70.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.384 -0.823 . . . . 0.0 112.624 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -56.89 -32.15 65.59 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 168.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -67.96 -42.39 81.0 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.4 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 84.7 m-70 -56.98 -35.81 69.61 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.235 0.614 . . . . 0.0 111.389 171.541 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.12 -11.65 60.84 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.03 0.532 . . . . 0.0 110.277 -174.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.8 -4.01 19.78 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.972 0.909 . . . . 0.0 112.226 -177.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -156.61 -41.92 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 119.607 1.094 . . . . 0.0 113.368 -174.635 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 t -64.57 -10.33 25.4 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -165.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -122.37 7.75 9.62 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.862 -0.524 . . . . 0.0 109.872 -170.47 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -142.42 -35.21 0.43 Allowed 'General case' 0 C--N 1.361 1.104 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.23 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -82.19 -55.71 4.38 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.48 0.312 . . . . 0.0 111.148 -164.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -143.87 131.24 20.92 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.5 p -161.38 123.46 2.99 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 175.398 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.42 115.58 7.21 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -61.24 -19.25 61.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.182 0.593 . . . . 0.0 111.707 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 mt -96.12 -42.97 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.232 0 C-N-CA 123.62 0.768 . . . . 0.0 112.149 -175.432 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' CYS . . . . . 0.607 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.8 p -135.29 -5.11 2.33 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.44 1.018 . . . . 0.0 113.24 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.57 32.25 77.57 Favored Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.102 0.382 . . . . 0.0 113.873 176.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.607 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 52.9 tttm -69.89 -15.8 63.13 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -170.243 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt 76.13 112.68 0.07 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 124.52 1.128 . . . . 0.0 111.933 167.13 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -133.87 148.62 51.28 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.598 0.759 . . . . 0.0 111.847 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.57 -18.48 65.02 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.907 1.283 . . . . 0.0 113.821 -174.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.488 ' HG3' ' H ' ' A' ' 86' ' ' SER . 0.3 OUTLIER -144.84 148.31 33.85 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.851 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.46 -29.99 71.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.658 0.783 . . . . 0.0 110.288 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -56.6 -41.67 77.42 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.295 170.736 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.488 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 43.3 t -69.02 -30.42 68.79 Favored 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 122.951 0.5 . . . . 0.0 110.944 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.56 -44.49 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.737 0.815 . . . . 0.0 109.745 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -74.13 -36.35 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.141 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.22 -40.44 94.11 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.936 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.97 -29.64 66.8 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.765 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -72.09 -40.79 67.98 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.466 0.65 . . . . 0.0 109.77 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.0 63.08 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.637 178.202 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -98.78 -51.69 3.82 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.373 1.069 . . . . 0.0 112.029 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.3 t -92.85 -14.03 28.26 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.858 1.263 . . . . 0.0 111.405 -169.84 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.619 ' HB3' HG22 ' A' ' 98' ' ' VAL . 64.4 m-70 -131.37 56.16 22.97 Favored Pre-proline 0 CA--C 1.556 1.199 0 C-N-CA 122.835 0.454 . . . . 0.0 110.956 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.38 -32.19 26.35 Favored 'Trans proline' 0 C--N 1.387 2.57 0 C-N-CA 122.002 1.802 . . . . 0.0 111.282 175.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -127.35 99.3 5.59 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 173.065 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.619 HG22 ' HB3' ' A' ' 95' ' ' HIS . 41.4 t . . . . . 0 C--O 1.252 1.195 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.464 177.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t60 . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.7 ttp -136.12 -47.66 0.65 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.485 0.714 . . . . 0.0 110.069 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -122.39 51.63 1.37 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -125.92 83.92 2.22 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.514 -1.221 . . . . 0.0 107.909 -173.942 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -81.93 115.3 21.04 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.9 -1.5 . . . . 0.0 110.024 -175.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.418 HG22 ' H ' ' A' ' 17' ' ' GLU . 15.4 mm -105.31 137.49 34.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -175.527 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.654 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 43.5 t -80.93 -24.73 37.96 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.211 0.604 . . . . 0.0 110.256 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.418 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.4 tt0 117.5 -28.63 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 127.728 2.411 . . . . 0.0 110.541 167.05 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -133.06 -42.4 0.89 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.114 0.966 . . . . 0.0 108.587 -173.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 66.76 1.01 Allowed 'General case' 0 C--O 1.242 0.68 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.242 -178.386 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.654 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.04 124.2 1.5 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.989 162.095 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -67.74 -52.73 34.01 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 169.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -178.05 132.11 0.15 Allowed 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.393 1.477 . . . . 0.0 108.575 163.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -100.17 135.2 41.96 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 170.996 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -73.79 -10.99 60.23 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.262 0.625 . . . . 0.0 111.375 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -146.91 134.99 21.54 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 122.751 0.42 . . . . 0.0 110.833 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.636 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.1 m -59.82 -34.82 73.57 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.432 1.093 . . . . 0.0 111.588 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -62.36 -44.81 95.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.045 0.938 . . . . 0.0 110.748 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -66.89 -42.53 85.35 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.739 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -62.68 -34.87 78.01 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.439 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.67 69.16 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 123.754 0.659 . . . . 0.0 111.985 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 52' ' ' ARG . 39.6 t -63.92 -47.76 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.74 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -62.87 -39.9 95.85 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.194 0.998 . . . . 0.0 110.534 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 41.8 ttt180 -68.62 5.94 0.95 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.41 1.084 . . . . 0.0 111.842 -173.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.6 ptp -42.87 -20.8 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 126.512 1.925 . . . . 0.0 114.853 176.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.32 -58.46 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 108.637 178.676 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.44 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.54 10.52 37.03 Favored 'General case' 0 N--CA 1.501 2.113 0 C-N-CA 124.458 1.103 . . . . 0.0 113.137 -170.345 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.415 ' OG1' ' HB2' ' A' ' 39' ' ' GLU . 4.5 t -57.8 -65.12 0.69 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -164.485 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.67 36.4 91.24 Favored Glycine 0 N--CA 1.476 1.357 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.415 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 37.1 mt-10 -149.86 -34.77 0.17 Allowed 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.902 1.681 . . . . 0.0 107.781 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt 46.77 75.93 0.61 Allowed Pre-proline 0 C--N 1.371 1.539 0 C-N-CA 126.263 1.825 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.36 -74.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.382 2.33 0 C-N-CA 123.107 2.538 . . . . 0.0 111.842 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 51' ' ' CYS . 95.4 mt -145.49 98.94 3.22 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.443 ' HG2' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -129.85 141.76 50.78 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -168.444 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.6 t -66.1 102.9 0.87 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLU . . . . . 0.422 ' CD ' ' H ' ' A' ' 45' ' ' GLU . 0.9 OUTLIER -73.97 -1.47 19.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.828 0.851 . . . . 0.0 111.945 177.969 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.515 HD11 ' SD ' ' A' ' 61' ' ' MET . 3.4 mp -83.8 -55.6 6.91 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 N-CA-C 107.103 -1.444 . . . . 0.0 107.103 174.551 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 18.3 p -132.58 -97.92 0.3 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.396 176.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.476 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -155.46 131.19 3.0 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 116.906 -2.052 . . . . 0.0 109.078 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.0 t80 164.83 113.56 0.01 OUTLIER 'General case' 0 C--N 1.354 0.804 0 N-CA-C 102.402 -3.184 . . . . 0.0 102.402 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 43' ' ' GLN . 3.1 m -128.42 126.51 40.72 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 96.4 m -150.45 141.74 23.25 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.442 -175.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 31' ' ' VAL . 29.9 ptt180 -69.66 -12.19 61.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.588 0.755 . . . . 0.0 111.147 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -101.02 107.76 19.3 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.35 -41.77 29.51 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.127 1.371 . . . . 0.0 111.65 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.87 -29.48 59.99 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.68 -1.145 . . . . 0.0 113.023 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.2 m -69.41 -56.34 7.74 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.134 -0.354 . . . . 0.0 111.816 179.354 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.44 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.4 OUTLIER -75.68 -48.49 21.78 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.215 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -55.89 -31.38 62.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.446 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 27.2 m95 -83.98 -39.59 19.53 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.305 178.12 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -45.88 -37.86 6.76 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.515 ' SD ' HD11 ' A' ' 46' ' ' ILE . 23.0 ttp -62.61 -47.03 85.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.754 0.822 . . . . 0.0 111.252 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.75 -36.97 80.26 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.538 0.735 . . . . 0.0 111.24 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 64.2 mttm -62.58 -33.94 75.97 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.624 0.769 . . . . 0.0 111.255 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 67' ' ' ASP . 3.1 p80 -107.56 23.69 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -53.37 -34.71 58.71 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 121.19 0.519 . . . . 0.0 110.097 157.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.04 -30.04 28.37 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.991 0.916 . . . . 0.0 111.682 173.765 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ASP . . . . . 0.47 ' HA ' ' HB2' ' A' ' 64' ' ' HIS . 17.7 m-20 84.34 -55.91 0.12 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 126.651 1.98 . . . . 0.0 113.758 170.958 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.9 p -45.04 -34.62 2.6 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -166.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -104.69 0.08 28.0 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -171.754 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.46 ' HB2' ' HB3' ' A' ' 64' ' ' HIS . 54.2 m-85 -150.27 32.35 0.66 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.492 0.717 . . . . 0.0 111.41 -174.428 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 67' ' ' ASP . 39.2 mt-30 -86.17 -21.14 27.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.384 0.274 . . . . 0.0 110.487 172.792 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -140.69 131.56 25.96 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 104.51 -2.404 . . . . 0.0 104.51 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -158.36 153.94 26.2 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 123.53 0.732 . . . . 0.0 110.359 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.2 t -89.12 118.81 29.11 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 105.944 -1.872 . . . . 0.0 105.944 168.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -66.41 -19.81 65.9 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-O 121.024 0.44 . . . . 0.0 111.501 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -88.15 -37.32 10.39 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.279 0 C-N-CA 123.029 0.532 . . . . 0.0 111.785 -173.574 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.3 p -150.33 17.07 0.83 Allowed 'General case' 0 C--N 1.377 1.778 0 CA-C-N 119.449 1.022 . . . . 0.0 113.393 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 49.35 46.48 35.81 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 117.286 1.675 . . . . 0.0 117.286 160.77 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.68 -45.1 88.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 117.313 0.557 . . . . 0.0 111.241 173.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 69.07 112.72 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.484 1.114 . . . . 0.0 109.447 -167.813 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -111.32 167.89 9.95 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.209 1.004 . . . . 0.0 110.625 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.29 -31.51 71.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.179 0.592 . . . . 0.0 112.473 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HG2' ' H ' ' A' ' 86' ' ' SER . 0.0 OUTLIER -139.7 155.59 47.28 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.068 0.461 . . . . 0.0 110.403 177.872 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -62.43 -31.14 71.8 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.305 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -59.28 -38.54 80.4 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.513 0.725 . . . . 0.0 110.592 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.411 ' H ' ' HG2' ' A' ' 83' ' ' LYS . 67.6 m -70.28 -29.63 66.44 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 122.764 0.426 . . . . 0.0 111.571 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.06 -43.8 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.422 0.689 . . . . 0.0 109.688 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 80.6 t -71.57 -38.26 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.955 1.302 . . . . 0.0 109.239 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.01 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.71 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -72.32 -40.91 67.13 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.479 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -70.69 -38.6 73.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.77 0.828 . . . . 0.0 109.362 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.62 -28.81 68.05 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.451 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -91.62 -45.07 8.67 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.872 0.869 . . . . 0.0 111.207 -173.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.5 t -94.08 -23.35 18.01 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.746 1.219 . . . . 0.0 111.191 -169.507 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 -129.37 50.47 5.97 Favored Pre-proline 0 CA--C 1.569 1.677 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -79.48 -37.96 0.45 Allowed 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 121.67 1.58 . . . . 0.0 111.45 167.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -104.5 96.91 6.92 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 176.409 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 CA--C 1.555 1.162 0 CA-C-N 114.776 -1.102 . . . . 0.0 108.38 170.808 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 121.321 0.581 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.1 ttm -171.21 -45.91 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.599 1.16 . . . . 0.0 107.966 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -149.41 37.12 0.75 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.906 173.954 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.66 80.98 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -169.267 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -81.97 104.23 12.18 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.842 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -113.38 157.59 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 124.286 1.034 . . . . 0.0 109.777 -171.046 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.9 t -119.75 37.15 4.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.267 1.427 . . . . 0.0 108.149 -173.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 53.17 -37.46 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 127.827 2.451 . . . . 0.0 117.144 -172.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -133.86 -48.84 0.81 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.899 0.88 . . . . 0.0 110.629 -167.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -113.5 29.98 7.58 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.954 -168.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.29 142.11 46.22 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.89 0.852 . . . . 0.0 111.825 167.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 21' ' ' ARG . 13.9 ptp180 -72.54 -114.53 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 113.363 -1.744 . . . . 0.0 108.178 164.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -137.2 124.41 21.75 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 161.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -109.1 136.6 48.33 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -87.98 0.71 55.57 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 t -146.26 140.4 26.48 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 122.885 0.474 . . . . 0.0 110.126 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.0 m -46.09 -56.77 5.16 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.361 1.465 . . . . 0.0 113.266 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 31' ' ' VAL . 93.5 m-70 -69.34 -33.54 73.26 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.677 0.791 . . . . 0.0 111.776 -175.286 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -51.32 -55.37 18.73 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.063 0.945 . . . . 0.0 111.446 175.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.38 -45.7 87.79 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 114.889 -1.05 . . . . 0.0 112.187 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.66 -27.52 50.37 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.606 0.763 . . . . 0.0 112.785 178.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 27' ' ' HIS . 63.1 t -64.98 -51.14 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.358 0.663 . . . . 0.0 110.417 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -61.57 -40.11 93.55 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.382 0.673 . . . . 0.0 109.831 175.592 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 39.4 ttt180 -67.26 4.71 0.88 Allowed 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.622 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -45.46 -17.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 125.708 1.603 . . . . 0.0 114.957 174.156 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.99 -59.69 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.43 0 C-N-CA 125.128 1.371 . . . . 0.0 109.213 176.233 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.44 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -102.05 9.35 40.43 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.132 0.973 . . . . 0.0 112.98 -171.065 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.5 t -58.53 -56.39 22.7 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.89 0.876 . . . . 0.0 113.247 -170.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.18 -32.07 3.08 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 119.835 -0.425 . . . . 0.0 112.544 -170.116 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.13 -37.27 69.49 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 123.729 0.812 . . . . 0.0 111.306 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 68.02 110.35 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.927 1.291 . . . . 0.0 111.599 -170.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.84 -164.65 0.28 Allowed 'Trans proline' 0 C--N 1.383 2.354 0 C-N-CA 122.551 2.167 . . . . 0.0 110.352 165.415 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.6 mt -117.12 104.25 11.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.233 0.613 . . . . 0.0 109.48 -177.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 24.3 tm0? -127.25 141.39 51.74 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.682 0.793 . . . . 0.0 109.077 -168.095 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 t -69.49 107.98 3.59 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.612 0.765 . . . . 0.0 111.648 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -55.93 -27.54 52.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.73 1.212 . . . . 0.0 113.312 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.18 -57.51 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 122.736 0.414 . . . . 0.0 109.919 -174.84 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.5 p -129.45 -88.44 0.51 Allowed 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -154.08 145.9 13.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 116.997 -2.002 . . . . 0.0 108.781 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' GLN . 20.1 t80 165.5 110.91 0.01 OUTLIER 'General case' 0 C--N 1.358 0.954 0 N-CA-C 102.302 -3.221 . . . . 0.0 102.302 166.988 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -118.85 136.3 54.1 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -174.536 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.526 ' SG ' HD22 ' A' ' 57' ' ' LEU . 25.7 p -157.33 -173.99 4.68 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.759 -176.513 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.75 13.38 7.43 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.739 0.815 . . . . 0.0 109.029 172.215 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -121.63 104.94 9.99 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.652 1.181 . . . . 0.0 108.303 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -55.97 -31.78 63.31 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.439 1.096 . . . . 0.0 112.918 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.03 -43.08 91.58 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.49 1.119 . . . . 0.0 111.903 174.503 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -61.25 -55.89 26.87 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.452 0.701 . . . . 0.0 112.187 -171.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.526 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -75.4 -27.37 59.03 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.576 178.053 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -50.21 -44.97 53.4 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -80.79 -37.77 29.66 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 122.358 -0.214 . . . . 0.0 110.596 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 63' ' ' LYS . 83.1 t60 -48.5 -43.12 34.77 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.9 ptm -72.66 -33.84 66.84 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 119.218 0.917 . . . . 0.0 112.285 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -28.01 64.61 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.403 0.681 . . . . 0.0 111.183 168.1 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 60' ' ' HIS . 28.6 mtpp -72.39 -36.79 68.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.451 0.7 . . . . 0.0 110.364 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 -66.64 -24.73 66.34 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.507 0.723 . . . . 0.0 111.437 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -56.08 -29.13 60.09 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.731 0.812 . . . . 0.0 112.578 -171.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.64 -54.17 2.51 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 167.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -51.56 -41.29 61.02 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -165.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.3 p -59.49 -69.62 0.2 Allowed 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.886 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -138.43 -21.71 1.03 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.951 0.9 . . . . 0.0 110.62 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -94.65 45.03 1.11 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.58 1.152 . . . . 0.0 108.466 -170.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -97.61 0.31 47.06 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 114.44 -1.254 . . . . 0.0 110.948 -161.24 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.482 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 66.4 m-85 -137.03 136.95 38.88 Favored 'General case' 0 C--N 1.343 0.314 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -171.751 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.5 p -159.92 129.57 5.3 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.435 1.094 . . . . 0.0 108.093 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.51 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 6.2 t -67.39 122.91 18.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 169.518 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -53.51 -26.86 22.6 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -174.665 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.41 HG21 HG21 ' A' ' 98' ' ' VAL . 7.8 mt -109.42 -25.94 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.566 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -171.814 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 p -140.37 5.23 2.04 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-N 120.474 1.488 . . . . 0.0 113.258 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 51.88 42.86 54.27 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 114.695 0.638 . . . . 0.0 114.695 174.073 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.51 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 3.8 tmtp? -65.51 -39.01 91.34 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -176.093 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 72' ' ' PHE . 0.0 OUTLIER 76.58 122.59 0.05 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 125.065 1.346 . . . . 0.0 111.408 -174.754 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.5 m-85 -135.68 148.62 48.99 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.123 1.369 . . . . 0.0 108.444 176.548 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.8 -19.27 65.71 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -174.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.35 140.7 47.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 124.418 1.087 . . . . 0.0 108.14 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -58.88 -27.85 65.58 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.266 1.026 . . . . 0.0 110.653 175.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -56.88 -47.14 81.14 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.346 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.7 m -67.43 -27.68 67.26 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 122.431 0.292 . . . . 0.0 111.702 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t -71.22 -44.5 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.425 0.69 . . . . 0.0 110.098 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 79.5 t -73.78 -38.18 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.846 1.258 . . . . 0.0 109.592 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.01 96.23 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.521 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -73.32 -38.56 65.76 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.073 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -72.57 -37.71 68.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.963 0.505 . . . . 0.0 110.947 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.74 -30.39 69.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.103 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -90.15 -46.31 8.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.835 0.854 . . . . 0.0 111.643 -171.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 42.4 t -88.16 -19.04 27.48 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.463 1.105 . . . . 0.0 110.652 -172.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -139.52 59.21 13.61 Favored Pre-proline 0 CA--C 1.557 1.225 0 C-N-CA 123.649 0.78 . . . . 0.0 109.246 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.48 -40.17 69.09 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 122.532 2.155 . . . . 0.0 112.875 -176.019 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -139.81 97.68 3.31 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.541 0.736 . . . . 0.0 110.178 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' VAL . . . . . 0.41 HG21 HG21 ' A' ' 76' ' ' ILE . 98.1 t . . . . . 0 N--CA 1.482 1.144 0 C-N-CA 124.031 0.932 . . . . 0.0 108.63 169.542 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.33 0.109 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.5 tpt -152.05 99.56 2.55 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.878 0.871 . . . . 0.0 109.066 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.4 33.71 0.24 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.508 ' HA ' ' HB1' ' A' ' 22' ' ' ALA . 15.8 m-20 -121.99 86.09 2.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.52 -162.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -93.64 111.6 23.31 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.498 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.7 mm -108.35 145.67 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.558 -167.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.607 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 39.2 t -98.64 44.29 1.04 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 55.86 -40.53 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.226 2.61 . . . . 0.0 115.822 -172.373 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -134.94 -43.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.991 1.316 . . . . 0.0 109.414 -165.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -117.69 53.61 0.93 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.696 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.607 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -154.22 127.49 8.46 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.992 158.444 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -58.44 3.94 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 171.737 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.508 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -170.47 127.37 0.79 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.38 0.672 . . . . 0.0 110.867 164.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.66 157.72 16.75 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.443 0.697 . . . . 0.0 109.13 171.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -59.59 -36.08 75.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.156 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.2 m -145.75 155.85 43.22 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.223 0.535 . . . . 0.0 111.068 -176.106 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 p -59.03 -34.51 71.99 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.979 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -73.74 -33.16 64.21 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.269 0.628 . . . . 0.0 110.601 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.15 -50.94 69.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.278 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.403 HD13 ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -63.49 -33.14 74.92 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.374 0.67 . . . . 0.0 111.406 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.467 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -53.75 -27.51 28.99 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.425 1.078 . . . . 0.0 112.198 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 89.6 t -64.61 -48.06 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.864 0.865 . . . . 0.0 111.347 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.88 -37.84 82.28 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.638 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 52.4 ttt85 -62.64 -3.43 1.49 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.718 1.607 . . . . 0.0 112.615 -177.436 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 20.8 ptt? -45.06 -16.19 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.4 tp -85.51 -51.3 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 C-N-CA 125.358 1.463 . . . . 0.0 110.027 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.638 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -104.6 11.71 33.9 Favored 'General case' 0 N--CA 1.508 2.472 0 C-N-CA 125.158 1.383 . . . . 0.0 112.996 -178.311 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.623 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 7.1 t -57.95 -55.05 39.88 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -161.193 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.05 36.69 91.08 Favored Glycine 0 N--CA 1.473 1.164 0 N-CA-C 112.025 -0.43 . . . . 0.0 112.025 -171.982 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 33.7 mt-10 -158.82 -58.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -168.641 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 76.58 97.45 0.04 OUTLIER Pre-proline 0 C--N 1.352 0.708 0 C-N-CA 126.824 2.05 . . . . 0.0 111.504 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.33 172.16 12.71 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 122.508 2.139 . . . . 0.0 110.915 164.481 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -89.34 138.51 31.37 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -139.39 136.79 35.08 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.242 0.339 . . . . 0.0 110.277 -171.389 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.548 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 3.9 t -70.56 106.39 3.45 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.875 0.87 . . . . 0.0 109.433 175.85 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.33 16.65 1.23 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.834 0.854 . . . . 0.0 112.646 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.548 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 3.5 mp -94.53 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.351 0.656 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.515 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 23.7 p -116.32 -108.38 0.37 Allowed 'General case' 0 C--O 1.24 0.571 0 N-CA-C 104.206 -2.516 . . . . 0.0 104.206 172.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.515 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.09 159.85 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 108.593 -1.803 . . . . 0.0 108.593 155.773 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 15.4 t80 174.08 111.16 0.02 OUTLIER 'General case' 0 C--N 1.353 0.737 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.0 m -119.73 135.25 54.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -171.54 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.8 t -157.31 157.96 35.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.728 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.476 ' HD2' ' N ' ' A' ' 53' ' ' GLN . 2.2 ppt_? -78.47 -21.82 48.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.526 -1.215 . . . . 0.0 111.677 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.476 ' N ' ' HD2' ' A' ' 52' ' ' ARG . 8.0 tp60 -98.62 115.84 29.52 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -174.87 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.22 -34.27 63.8 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 176.535 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.98 -41.43 71.19 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 124.266 0.979 . . . . 0.0 111.85 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.2 m -57.42 -56.48 21.31 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.274 0.63 . . . . 0.0 112.174 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.2 pt? -76.29 -27.62 56.7 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.048 0.539 . . . . 0.0 111.969 177.763 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -50.4 -46.79 56.47 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 123.616 0.766 . . . . 0.0 112.59 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -81.02 -46.06 15.62 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.542 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 78.6 t60 -45.53 -43.09 11.59 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.6 ptm -63.1 -39.76 95.64 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 118.667 0.667 . . . . 0.0 111.459 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.86 -24.92 64.4 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 122.827 0.451 . . . . 0.0 111.625 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.477 ' HD2' ' CD1' ' A' ' 69' ' ' PHE . 73.6 mmtt -63.3 -29.95 71.18 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.5 0.32 . . . . 0.0 110.693 171.857 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -70.62 -8.33 50.91 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 124.083 0.953 . . . . 0.0 112.106 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -60.57 -53.33 58.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.064 0.545 . . . . 0.0 110.027 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.14 -12.54 15.37 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.587 0.755 . . . . 0.0 111.761 174.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 55.9 43.83 26.81 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.103 0.961 . . . . 0.0 110.258 -170.171 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -72.05 -63.95 1.04 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.596 -1.184 . . . . 0.0 111.103 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PHE . . . . . 0.542 ' HD2' ' HB3' ' A' ' 80' ' ' LYS . 92.1 m-85 -65.18 -6.14 8.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -71.34 -34.38 70.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.746 0.818 . . . . 0.0 110.298 168.573 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -113.16 12.17 18.99 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.635 1.174 . . . . 0.0 111.481 -173.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.43 ' CE2' ' HG3' ' A' ' 84' ' ' LYS . 23.6 m-85 -135.17 135.3 40.95 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 179.811 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.7 m -156.57 167.21 31.13 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.917 1.287 . . . . 0.0 109.91 178.271 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.414 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 36.2 t -96.68 124.09 40.56 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 162.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ASN . . . . . 0.406 ' OD1' HG13 ' A' ' 76' ' ' ILE . 14.7 p30 -62.45 -20.42 64.52 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' ILE . . . . . 0.406 HG13 ' OD1' ' A' ' 75' ' ' ASN . 7.2 mt -104.11 -37.05 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.912 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.8 p -134.62 13.09 3.74 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 119.62 1.1 . . . . 0.0 113.007 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 50.36 32.83 23.04 Favored Glycine 0 C--N 1.358 1.753 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 171.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.414 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 8.3 tmtm? -63.69 -35.17 79.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.889 0.876 . . . . 0.0 112.57 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.542 ' HB3' ' HD2' ' A' ' 69' ' ' PHE . 4.8 mptp? 75.09 115.61 0.06 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.384 1.074 . . . . 0.0 109.948 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 96.2 m-85 -124.22 154.6 39.92 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.769 0.827 . . . . 0.0 111.475 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.43 -41.26 98.58 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.434 1.094 . . . . 0.0 111.354 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.549 ' HB2' ' H ' ' A' ' 86' ' ' SER . 35.4 mtpt -121.61 144.59 48.66 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 123.823 0.849 . . . . 0.0 108.747 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 84' ' ' LYS . . . . . 0.43 ' HG3' ' CE2' ' A' ' 72' ' ' PHE . 52.3 mtmt -65.03 -31.21 72.33 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.091 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 85' ' ' ASP . . . . . 0.424 ' HB3' ' HE2' ' A' ' 83' ' ' LYS . 33.1 t70 -54.61 -46.0 73.76 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.387 1.075 . . . . 0.0 110.578 170.047 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.549 ' H ' ' HB2' ' A' ' 83' ' ' LYS . 19.7 m -62.53 -32.44 73.38 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 123.336 0.397 . . . . 0.0 111.993 176.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 45.2 t -74.62 -45.03 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.128 0.571 . . . . 0.0 110.113 -175.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 88' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 84' ' ' LYS . 99.3 t -70.92 -37.69 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.45 1.1 . . . . 0.0 109.29 -175.099 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.14 -38.43 82.16 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.673 -1.148 . . . . 0.0 109.511 177.302 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -73.06 -33.83 65.89 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.603 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -73.69 -45.75 50.45 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.199 0.599 . . . . 0.0 110.35 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.11 -21.0 66.33 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.672 0.789 . . . . 0.0 111.825 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -100.28 -49.96 4.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.995 0.918 . . . . 0.0 111.982 -175.217 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 28.6 t -99.81 -4.35 30.7 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.189 0.996 . . . . 0.0 111.427 -168.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' HIS . . . . . 0.417 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 54.0 m-70 -137.91 55.18 8.67 Favored Pre-proline 0 CA--C 1.568 1.651 0 C-N-CA 124.05 0.94 . . . . 0.0 110.804 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 96' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 75.0 Cg_exo -54.78 -45.74 38.65 Favored 'Trans proline' 0 C--N 1.39 2.741 0 C-N-CA 123.161 2.574 . . . . 0.0 113.27 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -137.87 97.41 3.42 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 124.024 0.93 . . . . 0.0 109.737 -178.283 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.56 1.34 0 C-N-CA 124.755 1.222 . . . . 0.0 109.599 172.251 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.1 m80 . . . . . 0 N--CA 1.482 1.156 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 71.9 mtm -114.1 129.84 56.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.556 0.743 . . . . 0.0 109.873 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -89.49 16.38 7.75 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.219 1.009 . . . . 0.0 109.803 174.731 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.502 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 4.7 m-20 -134.72 93.72 3.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.704 1.202 . . . . 0.0 108.362 -167.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -79.36 113.59 17.62 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.244 1.418 . . . . 0.0 109.948 177.406 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.8 mt -109.6 134.04 52.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 C-N-CA 123.585 0.754 . . . . 0.0 110.338 -175.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 9.9 t -80.16 103.01 9.74 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 159.813 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.97 -15.01 7.47 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.613 1.165 . . . . 0.0 112.834 -168.16 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.93 -40.16 5.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.005 0.522 . . . . 0.0 110.485 -171.385 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -141.8 48.84 1.6 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.356 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ALA . . . . . 0.485 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -155.54 148.28 24.21 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 163.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ARG . . . . . 0.415 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 10.5 ptp180 -71.86 -72.49 0.22 Allowed 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.785 168.894 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ALA . . . . . 0.502 ' HB1' ' HB3' ' A' ' 13' ' ' ASP . . . -171.15 154.63 4.1 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.234 1.013 . . . . 0.0 109.696 172.046 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -131.72 143.14 50.05 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.523 0.729 . . . . 0.0 109.335 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.17 -7.67 50.44 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.463 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.7 m -149.9 152.85 35.7 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.231 0.612 . . . . 0.0 110.395 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.0 t -61.5 -34.39 75.43 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.7 0.8 . . . . 0.0 111.726 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -73.28 -37.62 66.19 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.766 0.426 . . . . 0.0 110.788 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.59 -46.99 80.52 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.953 0.883 . . . . 0.0 109.927 173.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 tp -62.43 -39.12 92.27 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.592 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -54.33 -28.31 41.79 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.704 0.802 . . . . 0.0 112.496 176.529 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.0 t -63.73 -43.73 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.11 0.964 . . . . 0.0 111.185 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -70.5 -44.46 67.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.685 0.755 . . . . 0.0 110.391 170.339 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.571 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 49.7 ttp180 -70.87 4.43 2.58 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.059 -171.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' MET . . . . . 0.422 ' O ' HG21 ' A' ' 50' ' ' THR . 19.8 ptt? -44.82 -20.4 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.184 1.394 . . . . 0.0 114.079 170.976 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -47.13 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 125.434 1.494 . . . . 0.0 109.346 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -101.19 -11.34 19.61 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -172.94 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 33' ' ' ARG . 4.5 t -60.1 -41.88 93.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -152.277 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.8 39.6 89.87 Favored Glycine 0 C--N 1.347 1.17 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.646 -178.604 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.6 -80.74 0.52 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -171.313 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 164.05 93.54 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.336 1.854 . . . . 0.0 109.231 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -97.13 -155.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 124.044 3.162 . . . . 0.0 111.08 173.599 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.3 mt -93.28 83.25 4.58 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -118.97 136.06 54.29 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.745 -171.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.723 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 8.3 t -68.95 106.72 2.84 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.166 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -93.6 53.43 1.86 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.645 1.212 . . . . 0.0 108.056 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.723 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -134.28 -7.14 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 125.938 1.695 . . . . 0.0 108.978 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 13.1 p -178.68 -118.09 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 103.733 -2.691 . . . . 0.0 103.733 -168.158 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.69 134.68 4.84 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 161.347 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.8 t80 178.1 117.99 0.04 OUTLIER 'General case' 0 C--N 1.351 0.653 0 N-CA-C 102.481 -3.155 . . . . 0.0 102.481 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 34' ' ' MET . 6.8 m -124.57 147.4 48.47 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.213 0.915 . . . . 0.0 110.141 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.532 ' SG ' HD22 ' A' ' 57' ' ' LEU . 16.2 p -148.9 179.14 8.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.016 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.35 23.4 6.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.135 1.374 . . . . 0.0 108.142 177.293 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -146.52 118.2 8.07 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.298 -167.087 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 -47.22 71.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.494 1.118 . . . . 0.0 113.094 -175.675 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.36 -33.25 70.94 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.0 m -63.65 -55.42 23.69 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.532 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -76.72 -26.35 54.55 Favored 'General case' 0 C--N 1.357 0.9 0 CA-C-N 118.09 0.405 . . . . 0.0 111.33 176.812 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.58 -49.61 72.28 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 173.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -79.19 -33.38 43.93 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.517 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 85.9 t60 -54.79 -38.51 67.39 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 167.096 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -31.25 62.57 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 120.127 1.33 . . . . 0.0 110.268 174.198 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LYS . . . . . 0.528 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 26.2 ttpp -61.21 -27.78 68.68 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.411 0.684 . . . . 0.0 111.709 167.538 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 6.4 mmpt? -63.3 -44.64 94.44 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 123.155 0.582 . . . . 0.0 110.864 169.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -66.4 -30.8 71.25 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.306 0.643 . . . . 0.0 111.107 172.112 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ASP . . . . . 0.528 ' HB3' ' HA ' ' A' ' 62' ' ' LYS . 22.4 t70 -79.82 -21.63 44.0 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.848 0.859 . . . . 0.0 109.09 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.3 75.01 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.938 0.895 . . . . 0.0 110.736 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.8 t70 81.73 -35.48 0.1 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.902 1.281 . . . . 0.0 111.479 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 p -70.24 -37.79 75.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.57 1.148 . . . . 0.0 111.645 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -61.82 -43.29 99.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.351 0.66 . . . . 0.0 110.629 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -94.62 65.09 3.09 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.198 0.999 . . . . 0.0 110.478 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -99.37 -37.91 9.04 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.292 169.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 43.2 m-85 -148.77 133.9 18.26 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 105.083 -2.191 . . . . 0.0 105.083 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -163.02 131.19 3.79 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.392 1.077 . . . . 0.0 108.292 174.152 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' CYS . . . . . 0.451 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 17.5 t -72.61 122.35 21.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 165.442 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -57.5 -27.04 62.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.186 0.994 . . . . 0.0 112.33 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.1 mt -94.84 -51.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.558 -174.925 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.0 p -128.82 11.24 6.1 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 119.455 1.025 . . . . 0.0 112.724 -172.494 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.81 41.69 28.07 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 114.68 0.632 . . . . 0.0 114.68 172.019 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.451 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 6.4 tmtm? -66.02 -41.83 90.46 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -177.718 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 72' ' ' PHE . 12.4 mptt 72.77 121.57 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.85 1.26 . . . . 0.0 110.771 -176.236 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -126.39 162.75 24.83 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.242 1.017 . . . . 0.0 111.378 -178.448 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -69.19 -18.73 63.95 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HG3' ' H ' ' A' ' 86' ' ' SER . 26.0 pttm -147.32 148.63 31.58 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.44 -25.22 67.91 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.326 0.65 . . . . 0.0 110.759 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -61.29 -38.11 85.64 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.349 0.66 . . . . 0.0 110.76 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.447 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 70.8 m -68.98 -30.0 68.33 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.83 0.452 . . . . 0.0 111.1 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 93.7 t -72.39 -44.32 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 C-N-CA 123.475 0.71 . . . . 0.0 109.999 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 68.1 t -72.27 -37.86 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.295 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.08 -37.3 85.46 Favored 'General case' 0 C--N 1.35 0.601 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.615 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -71.7 -31.63 66.96 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.068 0.947 . . . . 0.0 111.245 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -71.47 -37.66 71.32 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.58 0.705 . . . . 0.0 109.103 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.62 -27.47 61.29 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.548 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -88.38 -52.36 5.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.066 0.946 . . . . 0.0 111.183 -174.722 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.9 t -97.32 -16.49 20.26 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.053 0.941 . . . . 0.0 110.983 -167.282 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -134.97 37.01 0.34 Allowed Pre-proline 0 CA--C 1.571 1.771 0 CA-C-O 118.029 -0.986 . . . . 0.0 113.038 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -66.86 -33.3 34.04 Favored 'Trans proline' 0 C--N 1.394 2.963 0 CA-C-N 121.768 1.667 . . . . 0.0 112.541 -170.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -134.38 94.8 3.27 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 CA--C 1.56 1.358 0 CA-C-O 117.735 -1.126 . . . . 0.0 109.155 179.653 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.7 p80 . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.64 0.257 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.0 mtt -85.39 88.12 7.47 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.614 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -164.75 41.9 0.08 Allowed 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.746 0.784 . . . . 0.0 108.949 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -132.38 84.28 2.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -170.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.96 118.0 31.73 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 124.989 1.315 . . . . 0.0 109.074 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ILE . . . . . 0.555 HG22 ' H ' ' A' ' 17' ' ' GLU . 14.7 mm -125.29 156.61 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -169.249 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' CYS . . . . . 0.499 ' HB2' HD11 ' A' ' 29' ' ' LEU . 28.5 t -91.31 12.37 20.61 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.867 0.867 . . . . 0.0 110.285 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.555 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.8 mp0 88.21 -38.22 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.9 2.08 . . . . 0.0 110.705 169.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -139.17 -52.94 0.56 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.379 0.609 . . . . 0.0 109.993 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.8 p -98.52 70.5 1.96 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.218 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -148.97 -172.63 4.16 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 163.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -112.57 -104.5 0.39 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 175.163 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.76 134.05 22.99 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 161.941 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -118.26 165.33 13.96 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.572 0.749 . . . . 0.0 109.576 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -103.06 10.33 38.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.747 0.819 . . . . 0.0 111.045 177.405 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -169.01 139.74 2.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.056 0.943 . . . . 0.0 109.936 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.8 p -73.61 -37.47 65.39 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.182 0.993 . . . . 0.0 110.956 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.35 -35.13 73.37 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.526 177.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' VAL . 55.6 t30 -59.12 -54.18 49.9 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.456 0.646 . . . . 0.0 109.97 170.563 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -54.66 -30.05 54.2 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.46 1.504 . . . . 0.0 112.439 178.239 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.71 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -52.71 -24.29 8.37 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.455 HG22 ' O ' ' A' ' 28' ' ' ASN . 32.5 m -53.47 -49.12 56.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 170.929 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -74.94 -46.8 33.19 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.594 0.711 . . . . 0.0 109.273 172.533 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.71 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 19.2 ttt180 -76.82 41.87 0.29 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.615 1.566 . . . . 0.0 109.428 -173.543 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -66.79 -57.26 7.42 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.188 -163.302 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.4 tp -68.27 -26.98 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 168.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.568 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 43.1 m-70 -79.45 -34.86 41.17 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.094 1.77 . . . . 0.0 108.736 -158.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t -70.55 -36.58 73.74 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.268 -166.82 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.04 -30.71 9.84 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.734 -0.481 . . . . 0.0 112.339 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -46.38 -39.07 9.79 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.812 1.245 . . . . 0.0 114.027 170.518 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 58.39 87.37 0.14 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.549 1.14 . . . . 0.0 111.535 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.46 -179.48 4.12 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.097 1.865 . . . . 0.0 111.276 166.887 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.7 mt -111.92 130.72 55.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -111.93 138.03 49.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.174 0.59 . . . . 0.0 109.952 -174.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.447 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 3.5 t -63.31 116.9 5.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.05 0.94 . . . . 0.0 110.231 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.08 33.04 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.945 1.298 . . . . 0.0 112.356 -171.911 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.9 mm -133.66 -7.0 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 125.074 1.349 . . . . 0.0 108.679 -172.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.536 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 0.8 OUTLIER 174.05 -139.39 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 -160.593 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.536 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -143.46 135.9 6.65 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 108.22 -1.952 . . . . 0.0 108.22 172.162 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 31.5 t80 179.12 115.23 0.04 OUTLIER 'General case' 0 C--N 1.348 0.54 0 N-CA-C 102.614 -3.106 . . . . 0.0 102.614 -172.27 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.65 130.29 56.81 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 122.765 0.426 . . . . 0.0 110.255 -166.828 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' CYS . . . . . 0.637 ' SG ' ' HB2' ' A' ' 56' ' ' SER . 42.8 t -149.03 151.63 34.86 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.281 -179.245 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -80.49 -30.34 37.37 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.94 0.896 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -92.5 111.32 22.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.323 1.049 . . . . 0.0 109.12 -176.273 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -53.7 -35.22 60.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.59 1.156 . . . . 0.0 112.891 -175.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.01 -48.69 77.73 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 123.965 0.791 . . . . 0.0 111.634 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' SER . . . . . 0.637 ' HB2' ' SG ' ' A' ' 51' ' ' CYS . 46.4 m -52.07 -50.96 60.51 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -173.454 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.468 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.7 OUTLIER -72.18 -33.62 67.81 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 119.366 -0.35 . . . . 0.0 111.112 177.734 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -57.4 -38.38 74.2 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.853 0.861 . . . . 0.0 111.849 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 72.4 m95 -78.86 -27.42 44.11 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.549 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 16.3 t60 -77.25 -30.06 54.29 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.784 0.833 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.497 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 94.9 mtp -69.05 -38.69 79.26 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.849 0.46 . . . . 0.0 110.426 176.719 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -64.59 -28.48 69.66 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.175 176.036 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.549 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 28.9 mmmt -55.96 -36.54 67.93 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.544 0.338 . . . . 0.0 111.371 170.285 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.497 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 92.3 m-70 -75.0 -19.03 60.26 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.08 0.552 . . . . 0.0 111.539 176.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -91.94 -29.57 16.58 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 -172.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.25 -34.41 10.35 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.586 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.7 t70 55.21 37.4 28.85 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 123.178 1.466 . . . . 0.0 109.625 -165.377 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.8 p -62.31 -26.45 68.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.626 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -73.99 -34.82 64.33 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 123.408 0.683 . . . . 0.0 111.083 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 48.35 79.43 0.07 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.182 0.926 . . . . 0.0 110.161 -168.197 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -46.85 59.66 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.189 -175.346 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -152.13 135.95 16.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.599 -2.371 . . . . 0.0 104.599 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.4 p -157.42 119.07 3.7 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.444 0.698 . . . . 0.0 109.248 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.0 120.98 13.04 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.864 0.866 . . . . 0.0 109.417 172.067 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -57.39 -27.76 62.63 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.34 0.656 . . . . 0.0 112.077 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.1 mt -93.63 -39.35 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -172.797 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.5 p -135.1 -1.56 2.63 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.83 1.196 . . . . 0.0 113.095 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 58.27 34.19 73.2 Favored Glycine 0 C--N 1.364 2.096 0 N-CA-C 114.624 0.61 . . . . 0.0 114.624 172.016 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 81' ' ' PHE . 9.2 tmtt? -63.92 -39.57 94.48 Favored 'General case' 0 CA--C 1.56 1.349 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -173.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' LYS . 4.9 mptp? 80.55 119.74 0.05 Allowed 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 124.914 1.285 . . . . 0.0 110.534 -174.717 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 79.2 m-85 -133.13 149.06 52.12 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.623 1.169 . . . . 0.0 108.648 176.017 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -9.1 9.34 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -174.044 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HG3' ' H ' ' A' ' 86' ' ' SER . 24.2 pttm -151.52 147.17 26.5 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 173.013 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.42 -28.42 68.26 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.063 0.945 . . . . 0.0 110.689 176.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.69 -42.21 74.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.621 0.769 . . . . 0.0 111.462 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.462 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 75.4 m -71.11 -29.05 64.78 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.202 0.314 . . . . 0.0 111.156 176.324 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.3 t -72.55 -44.97 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.834 0.854 . . . . 0.0 110.06 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 87.3 t -72.73 -39.46 60.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 C-N-CA 124.73 1.212 . . . . 0.0 109.447 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.35 -37.33 85.1 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.609 177.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -71.92 -32.2 67.13 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.723 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -71.95 -38.75 69.74 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 109.583 -178.007 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.56 -17.77 59.95 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.024 177.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -97.65 -45.65 6.3 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.459 0.704 . . . . 0.0 111.591 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 45.2 t -100.42 -14.93 18.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.712 1.205 . . . . 0.0 111.409 -168.761 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -134.02 42.46 0.82 Allowed Pre-proline 0 CA--C 1.565 1.538 0 C-N-CA 123.826 0.85 . . . . 0.0 109.975 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.38 -29.28 62.92 Favored 'Trans proline' 0 C--N 1.387 2.597 0 C-N-CA 122.448 2.099 . . . . 0.0 113.885 -164.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.36 97.86 3.31 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 172.474 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 124.542 1.137 . . . . 0.0 109.517 176.879 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -167.81 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.066 0.946 . . . . 0.0 109.345 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -113.8 30.97 6.86 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 122.367 1.079 . . . . 0.0 108.132 177.234 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -120.75 80.99 1.7 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.423 -1.262 . . . . 0.0 107.89 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -78.84 118.38 20.82 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 113.393 -1.731 . . . . 0.0 109.501 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.2 mm -104.02 112.61 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.755 -171.249 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.5 t -59.99 101.43 0.12 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 161.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 31.48 -64.66 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 128.32 2.648 . . . . 0.0 115.592 160.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -125.04 -40.88 2.13 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.009 -166.48 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.16 -46.21 9.97 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.953 -163.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.82 127.16 31.42 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.163 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -68.74 -62.38 1.41 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.105 161.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.25 126.89 1.18 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.295 0.638 . . . . 0.0 110.833 164.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -98.71 144.72 27.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -71.88 -19.28 61.97 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -143.66 144.3 31.82 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.586 0.754 . . . . 0.0 110.055 -175.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' SER . . . . . 0.424 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.3 p -58.0 -32.98 68.44 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.853 0.861 . . . . 0.0 111.113 168.908 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' HIS . . . . . 0.457 ' O ' HG23 ' A' ' 31' ' ' VAL . 24.4 m-70 -68.03 -38.24 82.29 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.545 0.738 . . . . 0.0 109.994 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -49.45 75.24 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.136 0.974 . . . . 0.0 110.344 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.5 OUTLIER -60.69 -36.59 79.15 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.322 178.368 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.49 -30.88 71.93 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.534 1.146 . . . . 0.0 112.284 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 27' ' ' HIS . 48.3 t -66.45 -45.37 89.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.146 0.578 . . . . 0.0 110.443 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -33.66 68.47 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.524 0.729 . . . . 0.0 109.903 177.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.532 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 57.6 ttt180 -63.05 -2.55 1.3 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.619 1.168 . . . . 0.0 112.226 -176.013 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.9 ptm -45.93 -11.6 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 126.241 1.817 . . . . 0.0 114.612 173.574 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -83.75 -60.96 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.581 2.159 0 C-N-CA 124.934 1.294 . . . . 0.0 109.673 168.708 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' HIS . . . . . 0.532 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.24 9.85 37.96 Favored 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -172.538 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -61.81 -56.59 17.8 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -167.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.19 -32.65 3.77 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 123.353 0.501 . . . . 0.0 112.388 -167.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -70.68 -46.56 62.96 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.706 0.802 . . . . 0.0 111.614 176.215 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt 70.7 94.96 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 125.26 1.424 . . . . 0.0 110.934 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.14 -177.4 2.3 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.512 2.141 . . . . 0.0 111.069 174.049 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -110.38 109.26 19.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.254 0.622 . . . . 0.0 109.534 -170.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.28 146.29 39.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.626 0.77 . . . . 0.0 109.248 -178.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 4.3 t -64.35 108.49 1.63 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.635 0.774 . . . . 0.0 110.177 171.83 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -67.37 4.78 0.9 Allowed 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 36.6 mm -95.23 -54.73 6.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.441 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.6 p -120.47 -110.94 0.34 Allowed 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 48' ' ' GLY . . . . . 0.527 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.23 164.33 28.66 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 108.798 -1.721 . . . . 0.0 108.798 156.705 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.4 t80 171.24 110.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 102.449 -3.167 . . . . 0.0 102.449 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.65 132.44 56.68 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.79 0.805 . . . . 0.0 109.446 -164.396 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.1 t -152.54 166.19 32.79 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.317 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -100.37 -6.74 25.3 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.071 0.549 . . . . 0.0 110.37 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -113.21 112.3 23.53 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.396 1.078 . . . . 0.0 109.249 -175.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -51.95 -38.01 54.97 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.691 0.797 . . . . 0.0 112.537 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.64 -39.06 83.08 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.979 0.799 . . . . 0.0 112.364 -178.337 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -59.28 -54.98 40.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.293 0.637 . . . . 0.0 111.395 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LEU . . . . . 0.504 HD23 ' H ' ' A' ' 57' ' ' LEU . 0.6 OUTLIER -76.58 -29.5 56.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.057 0.543 . . . . 0.0 112.183 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.82 -37.18 63.31 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.583 0.753 . . . . 0.0 112.781 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' TRP . . . . . 0.445 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 95.7 m95 -80.55 -47.34 14.34 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.281 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 72.7 t60 -45.45 -42.49 10.55 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.565 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' MET . . . . . 0.5 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 26.0 ptm -67.2 -38.74 85.85 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 118.524 0.602 . . . . 0.0 112.4 174.916 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -63.33 -30.47 71.6 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.309 0.644 . . . . 0.0 111.3 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.514 ' HG2' ' HB2' ' A' ' 70' ' ' TYR . 95.4 mttt -66.6 -28.6 68.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.258 0.623 . . . . 0.0 111.253 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' HIS . . . . . 0.5 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 76.6 m-70 -66.19 -22.59 66.35 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.395 0.678 . . . . 0.0 111.166 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.05 -56.28 12.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.924 0.49 . . . . 0.0 110.036 -174.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.76 -8.87 59.74 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.215 0.606 . . . . 0.0 112.233 171.485 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t70 72.48 -59.76 0.55 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 126.025 1.73 . . . . 0.0 113.193 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.3 t -66.8 -67.66 0.43 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.863 1.265 . . . . 0.0 113.916 -166.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -138.39 9.24 2.69 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.071 0.948 . . . . 0.0 109.949 -169.887 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' TYR . . . . . 0.514 ' HB2' ' HG2' ' A' ' 63' ' ' LYS . 40.4 t80 68.28 9.14 7.05 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 124.06 0.944 . . . . 0.0 110.53 -164.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -108.8 -115.69 0.29 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.803 0.841 . . . . 0.0 110.262 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -145.93 138.6 25.65 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -166.148 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.7 m -133.33 158.59 42.6 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.319 1.048 . . . . 0.0 110.281 -176.286 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.5 t -97.71 116.26 29.59 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 167.478 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -64.96 -19.54 66.02 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.307 0.503 . . . . 0.0 111.763 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.62 -40.03 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.233 0.613 . . . . 0.0 111.683 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -141.08 -0.88 1.42 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.54 40.65 98.08 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 114.444 0.538 . . . . 0.0 114.444 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 5.9 tmtt? -66.36 -28.98 69.07 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 123.401 0.68 . . . . 0.0 112.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt 71.42 110.53 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 125.316 1.446 . . . . 0.0 111.037 172.637 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' PHE . . . . . 0.415 ' CE2' ' HB3' ' A' ' 79' ' ' LYS . 97.1 m-85 -120.38 164.64 16.05 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -172.027 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -67.99 -35.55 78.53 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 114.649 -1.159 . . . . 0.0 113.027 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.87 170.54 19.57 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 117.93 0.332 . . . . 0.0 111.633 175.704 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -57.47 -40.0 77.6 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.839 1.255 . . . . 0.0 110.913 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.35 -44.47 72.19 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 123.571 0.545 . . . . 0.0 111.228 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.5 m -63.78 -34.84 78.81 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.513 0.508 . . . . 0.0 111.742 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.79 -41.49 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.424 0.69 . . . . 0.0 110.251 -175.099 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 89.1 t -72.42 -38.6 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.877 1.271 . . . . 0.0 109.038 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.2 96.67 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.139 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -71.9 -31.56 66.53 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.952 -178.891 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.88 -45.23 62.04 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.21 -33.19 74.09 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.013 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -92.38 -47.63 7.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.533 0.733 . . . . 0.0 111.528 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.94 -7.46 21.47 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.616 0.766 . . . . 0.0 111.918 -168.728 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -134.63 42.69 0.82 Allowed Pre-proline 0 CA--C 1.567 1.632 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.17 -32.75 10.26 Favored 'Trans proline' 0 C--N 1.391 2.768 0 CA-C-N 121.407 1.538 . . . . 0.0 110.788 177.414 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -117.39 97.17 5.75 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.251 1.154 0 C-N-CA 123.993 0.917 . . . . 0.0 108.765 174.236 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? . . . . . 0 N--CA 1.484 1.231 0 CA-C-O 121.791 0.805 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -121.09 81.24 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-N 114.7 -1.137 . . . . 0.0 108.521 -173.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -78.64 110.23 13.57 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.962 -174.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.7 mm -109.19 131.78 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.774 0.83 . . . . 0.0 109.179 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.817 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 36.2 t -90.13 52.81 2.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.394 1.077 . . . . 0.0 109.025 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 56.76 -53.12 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 126.988 2.115 . . . . 0.0 115.48 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -134.44 -45.23 0.76 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.017 1.327 . . . . 0.0 109.817 -166.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.5 p -107.2 37.39 2.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.529 -167.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -142.68 122.93 13.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.193 0.597 . . . . 0.0 109.416 160.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -67.13 -55.65 13.3 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.413 1.071 . . . . 0.0 109.996 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.55 130.06 0.55 Allowed 'General case' 0 C--N 1.355 0.831 0 C-N-CA 124.036 0.934 . . . . 0.0 109.621 161.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -110.48 154.9 23.0 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.0 5.58 45.12 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -152.14 139.92 19.91 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.311 0.645 . . . . 0.0 109.55 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.479 ' HA ' HD23 ' A' ' 29' ' ' LEU . 32.3 t -52.56 -38.9 60.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.599 1.16 . . . . 0.0 111.958 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 31' ' ' VAL . 29.6 t-80 -69.84 -39.22 76.56 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.67 0.388 . . . . 0.0 111.345 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -56.86 -47.84 79.46 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.592 0.71 . . . . 0.0 110.911 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.696 HD11 HH11 ' A' ' 33' ' ' ARG . 0.2 OUTLIER -63.99 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.582 175.376 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.42 -27.86 68.84 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.866 0.866 . . . . 0.0 112.162 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.605 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 70.9 t -61.11 -45.2 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 124.039 0.935 . . . . 0.0 110.666 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.26 -36.65 74.59 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.967 0.507 . . . . 0.0 110.438 173.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.696 HH11 HD11 ' A' ' 29' ' ' LEU . 13.4 ttt180 -68.76 6.82 0.77 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.308 1.043 . . . . 0.0 112.608 -170.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptm -45.91 -15.67 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 125.901 1.681 . . . . 0.0 114.743 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.08 -54.32 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.309 0 C-N-CA 124.941 1.297 . . . . 0.0 109.05 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.549 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -107.3 2.03 24.25 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 -173.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.0 t -82.29 -41.43 20.16 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 120.058 1.299 . . . . 0.0 113.81 -165.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.04 -31.26 8.76 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.155 0.422 . . . . 0.0 114.155 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.48 ' H ' HG23 ' A' ' 37' ' ' THR . 2.2 mp0 -84.37 -51.26 7.1 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 117.231 0.516 . . . . 0.0 110.226 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 67.17 99.8 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.693 1.597 . . . . 0.0 111.546 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.605 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 73.9 Cg_endo -69.87 -147.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.985 2.457 . . . . 0.0 111.905 170.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.0 mt -129.32 116.95 19.86 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.739 -0.6 . . . . 0.0 111.726 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -108.98 142.74 39.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.953 0.901 . . . . 0.0 109.334 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.482 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 13.5 t -64.49 112.18 3.02 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 124.702 1.201 . . . . 0.0 109.689 170.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -79.52 29.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.0 1.32 . . . . 0.0 111.77 -174.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.482 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 2.8 mp -119.95 -16.0 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 124.494 1.118 . . . . 0.0 108.759 -173.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 1.4 p -175.97 -134.29 0.01 OUTLIER 'General case' 0 C--O 1.245 0.852 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 -156.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.552 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.94 131.48 4.14 Favored Glycine 0 C--N 1.309 -0.95 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 169.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 39.5 t80 176.9 113.37 0.03 OUTLIER 'General case' 0 C--N 1.349 0.573 0 N-CA-C 101.954 -3.35 . . . . 0.0 101.954 -175.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.0 m -128.73 139.99 51.95 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -166.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 57' ' ' LEU . 19.3 p -153.78 166.06 34.06 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.166 -174.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -88.88 -31.07 18.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.264 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 138.0 38.63 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.699 0.8 . . . . 0.0 109.121 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -36.05 82.59 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -174.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.39 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -55.49 -47.91 75.42 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 -173.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 2.0 pt? -76.41 -37.44 57.07 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.487 0.585 . . . . 0.0 111.044 173.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.8 -44.61 66.74 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.808 0.843 . . . . 0.0 113.034 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.419 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 100.0 m95 -80.9 -36.92 30.55 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.74 -177.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 58.5 t60 -53.84 -33.33 55.93 Favored 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 165.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.44 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 68.2 mtm -72.82 -37.86 67.35 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.449 0.568 . . . . 0.0 110.425 174.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -59.01 -34.16 71.55 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.808 0.843 . . . . 0.0 111.281 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.419 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 33.8 mmtp -56.87 -28.78 62.22 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.641 172.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 . . . . . 0 N--CA 1.48 1.029 0 C-N-CA 122.67 0.388 . . . . 0.0 110.745 179.011 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.0 m . . . . . 0 N--CA 1.477 0.91 0 N-CA-C 108.423 -0.955 . . . . 0.0 108.423 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -95.3 124.64 39.44 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 167.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 41.2 t30 -54.11 -39.29 66.26 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.296 0.569 . . . . 0.0 111.692 176.57 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 mt -86.12 -47.49 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.5 -166.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 20.3 p -126.99 3.42 6.53 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 119.319 0.963 . . . . 0.0 112.697 -175.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 52.61 37.87 51.21 Favored Glycine 0 C--N 1.361 1.972 0 N-CA-C 114.783 0.673 . . . . 0.0 114.783 174.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -30.29 71.4 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 122.83 0.452 . . . . 0.0 111.276 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt 75.11 122.34 0.04 OUTLIER 'General case' 0 C--N 1.36 1.045 0 C-N-CA 125.04 1.336 . . . . 0.0 109.587 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -130.86 162.91 28.58 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.551 0.741 . . . . 0.0 111.717 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.75 -44.46 96.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.399 1.08 . . . . 0.0 111.855 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 85' ' ' ASP . 5.5 ptmm? -140.99 156.33 46.06 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.353 0.661 . . . . 0.0 109.729 -173.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -60.85 -31.56 70.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.328 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.469 ' HB2' ' HG3' ' A' ' 83' ' ' LYS . 8.3 m-20 -56.32 -43.05 78.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.528 0.731 . . . . 0.0 111.688 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.4 m -64.54 -31.56 72.82 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.033 0.533 . . . . 0.0 111.389 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 41.8 t -75.66 -46.14 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.153 0.501 . . . . 0.0 110.479 -176.517 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 75.9 t -70.92 -38.04 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.15 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.88 90.76 Favored 'General case' 0 C--N 1.349 0.551 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.582 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -70.26 -37.61 74.95 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.881 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.81 -38.45 67.18 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.456 0.702 . . . . 0.0 109.787 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.83 -23.08 65.99 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.983 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -102.75 -49.29 3.85 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.6 t -88.48 -6.93 57.32 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.229 1.011 . . . . 0.0 111.607 -170.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 . . . . . 0 N--CA 1.478 0.952 0 C-N-CA 122.797 0.439 . . . . 0.0 110.2 179.164 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 . . . . . 0 N--CA 1.491 1.608 0 CA-C-O 122.069 0.937 . . . . 0.0 110.514 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 14.3 m-20 -144.64 100.21 3.48 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -172.876 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -86.64 104.48 16.1 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 20' ' ' ALA . 29.4 mm -111.12 133.12 57.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 -173.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.464 ' HA ' HD13 ' A' ' 29' ' ' LEU . 41.8 t -54.96 -53.0 61.28 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.853 0.861 . . . . 0.0 110.865 174.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 172.15 -53.75 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.972 1.309 . . . . 0.0 108.711 177.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -140.59 -45.69 0.41 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -175.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 p -88.03 64.64 7.88 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.581 -1.645 . . . . 0.0 109.703 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.443 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -157.7 134.0 9.59 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.063 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -81.16 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 166.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.41 124.86 1.46 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.653 0.781 . . . . 0.0 108.986 165.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.438 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 96.7 m-85 -102.34 150.59 23.18 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.64 0.776 . . . . 0.0 109.414 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -76.19 -17.24 59.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.847 0.459 . . . . 0.0 112.167 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -146.88 150.36 35.07 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.054 0.541 . . . . 0.0 110.701 -174.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 66.5 p -58.73 -34.21 71.09 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.408 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -74.02 -35.49 64.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.763 0.825 . . . . 0.0 110.955 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -60.62 -48.41 81.89 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.623 0.769 . . . . 0.0 109.906 174.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -66.6 -35.07 79.3 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.619 177.136 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.14 68.04 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.29 0.994 . . . . 0.0 111.88 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -56.62 -49.99 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 124.199 1.0 . . . . 0.0 111.411 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -34.9 65.99 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.398 0.618 . . . . 0.0 109.559 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 63.6 ttt180 -63.73 -7.76 8.55 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.682 -175.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptm -43.97 -15.19 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.25 -50.42 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.675 0 C-N-CA 124.559 1.143 . . . . 0.0 109.762 175.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.61 10.58 38.65 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 125.009 1.323 . . . . 0.0 112.36 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.514 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 9.0 t -55.91 -67.41 0.29 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -155.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' THR . . . 69.81 36.56 74.63 Favored Glycine 0 N--CA 1.473 1.147 0 CA-C-N 118.644 0.656 . . . . 0.0 112.383 -176.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -169.74 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.302 1.441 . . . . 0.0 108.181 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 66.53 97.92 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.166 1.386 . . . . 0.0 113.555 164.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.51 164.33 26.22 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.099 1.866 . . . . 0.0 110.046 160.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.93 121.32 42.88 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.574 0.75 . . . . 0.0 109.17 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -109.57 143.53 39.14 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -174.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 14.5 t -69.57 109.68 4.42 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.725 0.81 . . . . 0.0 109.375 176.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 40.63 0.96 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.779 0.832 . . . . 0.0 110.428 -178.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.421 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.7 mp -130.97 -12.78 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 C-N-CA 124.945 1.298 . . . . 0.0 108.356 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 4.8 p -175.57 -124.33 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 N-CA-C 102.693 -3.077 . . . . 0.0 102.693 -167.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.95 134.69 4.95 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 117.251 -1.86 . . . . 0.0 108.638 163.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.8 t80 177.57 115.95 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 102.538 -3.134 . . . . 0.0 102.538 -176.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 m -110.48 146.19 36.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.504 0.669 . . . . 0.0 109.724 -171.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 43.6 t -144.83 -170.95 3.52 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 125.675 1.59 . . . . 0.0 107.886 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 14.5 ptm180 -131.94 -19.96 2.54 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.694 0.798 . . . . 0.0 110.717 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.635 HE22 ' HB3' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -102.26 125.06 48.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.173 0.989 . . . . 0.0 108.353 -179.329 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -52.9 -56.08 18.57 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.472 1.109 . . . . 0.0 113.266 -172.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.635 ' HB3' HE22 ' A' ' 53' ' ' GLN . . . -53.71 -39.66 65.4 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.048 0.539 . . . . 0.0 112.193 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.565 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 23.5 t -54.75 -55.74 26.71 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.557 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.0 pt? -74.07 -26.31 60.32 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.042 0.383 . . . . 0.0 110.866 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' MET . 6.0 t30 -62.88 -25.11 68.14 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.609 0.764 . . . . 0.0 112.126 169.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.2 m95 -82.62 -39.1 22.63 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.62 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 63.1 t60 -58.33 -31.12 67.25 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 169.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 26.2 ptm -71.7 -31.44 66.75 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 119.496 1.044 . . . . 0.0 110.329 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -61.29 -32.67 72.52 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.126 0.571 . . . . 0.0 111.311 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 27.5 mmmt -62.66 -35.86 81.0 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.832 170.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 . . . . . 0 N--CA 1.494 1.729 0 C-N-CA 123.244 0.617 . . . . 0.0 111.584 170.161 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.596 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 13.3 p . . . . . 0 N--CA 1.453 -0.279 0 CA-C-O 121.469 0.652 . . . . 0.0 109.498 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.8 t -109.55 115.35 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -67.75 -14.64 63.12 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.492 HD11 ' HE3' ' A' ' 91' ' ' LYS . 2.6 mt -90.06 -38.6 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.423 0.689 . . . . 0.0 112.078 -174.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -137.76 -1.72 2.0 Allowed 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.59 38.78 93.58 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 113.895 0.318 . . . . 0.0 113.895 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -40.47 92.07 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 122.923 0.489 . . . . 0.0 111.672 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 14.0 mptt 72.54 116.81 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.947 1.299 . . . . 0.0 111.034 -177.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -125.1 163.67 21.89 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.854 0.862 . . . . 0.0 111.176 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -73.66 -44.85 55.67 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.741 0.816 . . . . 0.0 112.419 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -145.7 163.4 35.02 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.727 0.411 . . . . 0.0 111.793 -167.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -49.67 -39.35 36.21 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 125.488 1.515 . . . . 0.0 112.062 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.91 -46.25 67.93 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.458 1.099 . . . . 0.0 111.154 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -71.98 -35.75 69.6 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.517 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -75.28 -51.04 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 123.963 0.905 . . . . 0.0 111.345 -170.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.01 -34.38 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.257 -172.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.92 88.57 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.304 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.18 -33.7 67.88 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.998 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.492 ' HE3' HD11 ' A' ' 76' ' ' ILE . 87.2 tttt -73.12 -44.36 60.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.322 0.582 . . . . 0.0 110.171 -178.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.76 -22.54 67.01 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.768 -1.105 . . . . 0.0 112.174 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -106.35 -50.19 3.2 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.1 t -90.66 -9.3 47.38 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.52 0.728 . . . . 0.0 111.49 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.8 m-70 . . . . . 0 N--CA 1.484 1.266 0 C-N-CA 123.295 0.638 . . . . 0.0 110.634 178.881 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 . . . . . 0 N--CA 1.475 0.82 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -129.25 83.27 2.13 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -170.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -97.8 120.89 39.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.573 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.686 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -118.42 157.87 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.067 0.947 . . . . 0.0 109.147 -164.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.688 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.9 t -96.74 -12.37 23.82 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.186 0.594 . . . . 0.0 110.744 176.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.686 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.5 tt0 97.59 -20.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 126.513 1.925 . . . . 0.0 111.065 167.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -135.9 -51.5 0.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.871 0.843 . . . . 0.0 109.138 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.9 p -121.17 72.67 1.0 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.464 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.688 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.03 145.74 4.32 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.966 0.889 . . . . 0.0 112.694 163.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.13 -168.23 1.05 Allowed 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 113.318 -1.764 . . . . 0.0 109.377 162.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.75 125.44 30.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.19 0.596 . . . . 0.0 109.823 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.588 ' HE1' ' HB1' ' A' ' 20' ' ' ALA . 77.1 m-85 -111.53 148.88 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.742 0.817 . . . . 0.0 109.044 174.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -61.98 -30.17 70.76 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.091 0.556 . . . . 0.0 111.669 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 53.1 m -144.85 151.06 38.18 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.32 0.648 . . . . 0.0 110.83 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.534 ' HA ' HD23 ' A' ' 29' ' ' LEU . 34.4 t -57.55 -37.11 72.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.871 0.868 . . . . 0.0 111.462 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 -69.54 -35.25 75.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.028 0.931 . . . . 0.0 111.98 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.92 -45.88 91.77 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.462 0.648 . . . . 0.0 110.643 174.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -68.36 -29.54 68.28 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.676 174.274 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.75 -26.31 68.63 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.349 0.66 . . . . 0.0 111.568 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 64.1 t -61.84 -47.64 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 122.845 0.458 . . . . 0.0 110.241 171.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -62.32 -38.4 89.29 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.732 0.813 . . . . 0.0 110.407 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -65.29 2.37 0.86 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.733 1.213 . . . . 0.0 112.214 -175.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.1 ptp -44.81 -19.48 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 125.209 1.404 . . . . 0.0 113.425 171.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.9 tp -86.52 -51.02 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 125.538 1.535 . . . . 0.0 110.572 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.87 5.33 40.93 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 123.451 0.7 . . . . 0.0 112.235 -173.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.7 t -59.32 -57.33 13.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -164.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.67 -31.66 2.18 Favored Glycine 0 CA--C 1.538 1.53 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 -169.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.43 -45.82 57.87 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 109.91 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt 66.42 98.3 0.04 OUTLIER Pre-proline 0 C--N 1.357 0.932 0 O-C-N 124.918 1.386 . . . . 0.0 111.072 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -70.68 -170.89 0.49 Allowed 'Trans proline' 0 C--N 1.382 2.339 0 C-N-CA 122.899 2.399 . . . . 0.0 111.391 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 54' ' ' LYS . 39.8 mt -99.02 119.37 37.67 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -172.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 49' ' ' PHE . 50.7 tt0 -135.45 144.38 46.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 122.716 0.407 . . . . 0.0 111.542 -171.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 6.6 t -64.93 107.7 1.56 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.174 0.989 . . . . 0.0 110.684 174.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.62 14.58 1.25 Allowed 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.175 0.99 . . . . 0.0 112.551 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.45 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 32.3 mm -96.53 -53.66 7.88 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 20.1 p -119.65 -107.15 0.37 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.517 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.5 166.82 29.68 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 156.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.414 ' H ' ' HG3' ' A' ' 43' ' ' GLN . 74.5 t80 168.45 111.26 0.01 OUTLIER 'General case' 0 C--N 1.346 0.452 0 N-CA-C 102.185 -3.265 . . . . 0.0 102.185 175.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -115.05 132.93 56.44 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.559 0.695 . . . . 0.0 109.214 -169.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.6 t -149.43 175.28 11.61 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.971 -1.468 . . . . 0.0 109.024 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.6 ppt_? -103.41 3.25 34.88 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.907 0.883 . . . . 0.0 110.891 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -127.9 103.74 7.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.046 0.938 . . . . 0.0 108.645 -174.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.486 ' HB3' HD13 ' A' ' 42' ' ' LEU . 21.0 ptmt -58.6 -28.83 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.568 0.747 . . . . 0.0 112.57 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.19 -39.79 70.01 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.926 0.89 . . . . 0.0 111.829 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.4 t -63.22 -54.64 34.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.768 0.827 . . . . 0.0 111.172 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.538 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -74.29 -27.67 60.83 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.98 0.512 . . . . 0.0 112.224 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.457 ' O ' ' HG2' ' A' ' 61' ' ' MET . 44.3 t30 -51.48 -51.66 53.16 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.603 0.761 . . . . 0.0 112.17 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -81.75 -32.41 31.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.564 0.221 . . . . 0.0 111.028 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.538 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 76.0 t60 -48.97 -42.43 37.65 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 163.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.528 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 17.2 ptm -70.99 -31.87 68.53 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 119.617 1.099 . . . . 0.0 111.604 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 3.0 tppp? -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.253 0.621 . . . . 0.0 111.351 170.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 48.0 mmtm -63.12 -36.51 83.84 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.624 0.369 . . . . 0.0 110.58 172.975 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.6 m-70 . . . . . 0 N--CA 1.485 1.315 0 C-N-CA 123.556 0.742 . . . . 0.0 109.86 178.102 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 33.4 t . . . . . 0 C--O 1.233 0.23 0 CA-C-O 121.366 0.603 . . . . 0.0 110.556 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 12.1 t -90.14 125.04 35.31 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 172.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -52.87 -30.68 35.26 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.815 0.846 . . . . 0.0 113.153 -178.004 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -103.79 -30.92 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -163.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 18.8 p -136.85 -0.31 2.33 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.863 0.756 . . . . 0.0 112.099 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 59.56 34.35 81.04 Favored Glycine 0 C--N 1.358 1.779 0 N-CA-C 114.301 0.48 . . . . 0.0 114.301 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 7.6 tmtt? -63.37 -30.62 71.72 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.462 1.105 . . . . 0.0 112.442 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm 74.13 116.69 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.742 1.217 . . . . 0.0 111.28 175.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.411 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 94.9 m-85 -131.32 159.37 38.08 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.693 0.797 . . . . 0.0 110.269 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.34 -31.18 67.07 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.422 0.689 . . . . 0.0 111.729 -177.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 86' ' ' SER . 18.2 ptpt -134.04 148.06 51.02 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.55 -35.56 68.27 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.916 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.98 -45.96 71.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.149 0.979 . . . . 0.0 111.132 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.426 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 19.9 t -69.32 -28.36 66.18 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.043 0.537 . . . . 0.0 110.839 -176.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 87.0 t -70.57 -46.77 68.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.019 0.928 . . . . 0.0 109.967 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.1 t -71.93 -36.22 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.819 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.36 79.48 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.622 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -70.9 -34.55 71.68 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.529 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -38.53 71.1 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.089 0.956 . . . . 0.0 109.351 -174.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.51 -18.13 63.65 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.778 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -96.51 -49.78 5.0 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.422 0.689 . . . . 0.0 110.792 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.0 t -82.79 -32.31 27.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.255 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 . . . . . 0 CA--C 1.573 1.85 0 C-N-CA 122.761 0.424 . . . . 0.0 111.505 -171.702 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.483 1.202 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.402 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 3.2 p-10 -172.95 103.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.676 -172.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -84.76 124.85 32.01 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.334 0.654 . . . . 0.0 110.74 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.588 HG22 ' H ' ' A' ' 17' ' ' GLU . 5.3 mm -115.03 150.77 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 -172.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.691 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 t -83.97 -19.1 35.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.2 0.6 . . . . 0.0 109.492 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 15' ' ' ILE . 32.4 tt0 77.06 0.37 3.05 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.787 1.635 . . . . 0.0 110.701 173.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -136.16 -50.48 0.69 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.107 0.963 . . . . 0.0 108.612 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.36 77.05 1.53 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.56 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.691 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.52 137.37 2.26 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.942 0.897 . . . . 0.0 110.948 167.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.429 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 ptt180 -70.3 -77.95 0.08 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.337 168.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.429 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -163.44 149.42 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.449 0.7 . . . . 0.0 110.233 171.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -126.83 152.63 46.73 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.379 0.671 . . . . 0.0 110.258 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -61.76 -32.62 72.89 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.63 0.772 . . . . 0.0 112.357 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -147.63 160.04 43.1 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.887 0.375 . . . . 0.0 111.118 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 p -56.68 -35.67 68.73 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.259 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -75.9 -35.55 59.77 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.0 0.92 . . . . 0.0 112.501 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -50.41 69.88 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.158 0.98 . . . . 0.0 109.041 169.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -60.02 -40.2 88.46 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 113.767 -1.56 . . . . 0.0 112.523 172.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.615 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -56.47 -26.9 55.54 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.617 0.767 . . . . 0.0 112.571 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.451 HG13 HG21 ' A' ' 50' ' ' THR . 85.5 t -60.35 -44.96 97.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 123.862 0.865 . . . . 0.0 110.681 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -72.15 -45.98 58.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.523 0.729 . . . . 0.0 110.769 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.615 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 29.8 ttt180 -63.39 -5.13 3.23 Favored 'General case' 0 C--O 1.212 -0.92 0 C-N-CA 125.779 1.632 . . . . 0.0 111.467 -174.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.5 ptm -47.44 -12.91 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 125.338 1.455 . . . . 0.0 114.69 173.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -83.99 -52.57 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.579 0 C-N-CA 124.715 1.206 . . . . 0.0 109.431 173.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -104.7 1.41 29.35 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.7 t -70.74 -49.61 45.04 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -165.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.94 -30.55 3.55 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-O 120.01 -0.328 . . . . 0.0 112.403 -164.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -103.8 76.87 1.41 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 124.713 1.205 . . . . 0.0 108.444 175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -52.79 131.56 47.59 Favored Pre-proline 0 CA--C 1.558 1.272 0 C-N-CA 123.333 0.653 . . . . 0.0 111.969 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.85 -172.87 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.568 2.179 . . . . 0.0 111.238 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.4 mt -103.06 99.36 9.24 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.51 134.15 55.31 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -166.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.431 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 23.2 t -74.66 106.65 6.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.896 0.878 . . . . 0.0 110.189 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.11 42.26 1.02 Allowed 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.164 0.983 . . . . 0.0 110.493 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.431 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.3 mp -127.78 -2.28 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.563 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 6.6 p 173.71 -136.79 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 -168.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.503 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -144.39 127.07 2.84 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.889 -2.084 . . . . 0.0 107.889 171.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.9 t80 179.7 112.02 0.04 OUTLIER 'General case' 0 C--O 1.237 0.434 0 N-CA-C 102.147 -3.279 . . . . 0.0 102.147 -167.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.451 HG21 HG13 ' A' ' 31' ' ' VAL . 2.9 m -123.56 144.96 49.24 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.612 0.72 . . . . 0.0 109.804 -170.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 81.6 m -147.26 171.16 15.84 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.696 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.491 ' HD2' ' H ' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -117.42 -7.2 11.18 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.887 170.198 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -102.83 111.77 24.26 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 169.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -58.32 -33.88 69.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.604 0.761 . . . . 0.0 111.277 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.64 -42.82 71.72 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 124.456 1.098 . . . . 0.0 112.413 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -55.27 -53.78 51.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.967 0.907 . . . . 0.0 112.442 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.596 ' H ' HD23 ' A' ' 57' ' ' LEU . 1.1 pt? -75.86 -27.39 57.78 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.066 0.547 . . . . 0.0 111.567 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 61' ' ' MET . 67.0 t30 -55.1 -44.76 75.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.783 0.833 . . . . 0.0 113.208 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.491 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 66.0 p-90 -82.52 -39.79 21.9 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 122.03 -0.419 . . . . 0.0 110.345 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 75.9 t60 -48.06 -35.25 10.9 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 171.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 23.7 ptp -70.03 -37.56 75.65 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 119.174 0.897 . . . . 0.0 111.043 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 19.4 ttmm -56.93 -37.11 71.04 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.872 0.869 . . . . 0.0 110.699 172.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -61.3 -31.39 71.23 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.654 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 . . . . . 0 N--CA 1.49 1.545 0 C-N-CA 123.302 0.641 . . . . 0.0 111.706 176.508 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.407 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 89.3 p . . . . . 0 C--O 1.24 0.566 0 CA-C-O 121.801 0.81 . . . . 0.0 111.133 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.66 117.4 30.04 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -67.41 -9.39 41.22 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.337 0.517 . . . . 0.0 112.299 -174.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 91' ' ' LYS . 3.2 mt -96.69 -37.39 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.199 0.6 . . . . 0.0 111.905 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.9 p -139.64 8.79 2.39 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 54.0 42.8 71.69 Favored Glycine 0 C--N 1.344 1.019 0 C-N-CA 123.884 0.755 . . . . 0.0 114.885 173.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -66.52 -39.34 88.6 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.407 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 11.6 mptt 71.23 117.75 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 124.417 1.087 . . . . 0.0 109.853 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 87.6 m-85 -124.39 170.63 10.64 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.73 0.812 . . . . 0.0 110.148 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HG2' ' A' ' 83' ' ' LYS . 13.7 pt-20 -64.29 -41.34 96.93 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.369 173.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HG2' ' HG3' ' A' ' 82' ' ' GLU . 17.3 ptpt -142.27 157.64 44.6 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.318 0.647 . . . . 0.0 109.554 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -67.7 -21.99 65.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.64 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -60.13 -43.98 95.27 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.495 0.318 . . . . 0.0 110.76 171.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.2 m -66.07 -29.28 69.59 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.178 0.591 . . . . 0.0 111.449 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 65.3 t -71.37 -49.18 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.013 0.925 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 96.0 t -74.34 -33.01 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.838 1.255 . . . . 0.0 109.92 -174.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.85 89.02 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.802 173.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -73.96 -35.35 64.51 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.272 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 76' ' ' ILE . 85.0 tttt -70.88 -46.7 62.14 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.44 1.096 . . . . 0.0 111.213 -169.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -20.75 66.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.684 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.2 mmtm -99.03 -47.62 5.17 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.117 0.567 . . . . 0.0 111.006 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.2 t -84.84 -20.25 31.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.018 0.927 . . . . 0.0 111.761 -170.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 122.975 0.51 . . . . 0.0 110.258 -176.244 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 . . . . . 0 CA--C 1.544 0.73 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.73 101.92 3.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -99.48 115.03 28.35 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.465 HG23 ' HB3' ' A' ' 20' ' ' ALA . 31.6 mm -119.36 134.18 63.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -170.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.8 t -57.69 -51.43 69.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.264 1.025 . . . . 0.0 110.711 172.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 166.14 -54.08 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 125.758 1.623 . . . . 0.0 109.367 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -137.46 -51.3 0.63 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.308 -169.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -90.78 61.39 4.74 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.112 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.465 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -153.94 128.64 9.38 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.02 169.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -69.79 -79.45 0.06 Allowed 'General case' 0 CA--C 1.55 0.942 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 169.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.72 140.63 5.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.204 1.002 . . . . 0.0 108.613 163.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.25 145.12 43.39 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.678 0.791 . . . . 0.0 109.044 175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -78.78 -9.36 59.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.857 0.463 . . . . 0.0 112.035 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -147.06 147.13 30.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.299 0.64 . . . . 0.0 110.77 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.435 ' HA ' HD23 ' A' ' 29' ' ' LEU . 22.6 t -62.09 -34.34 76.12 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.01 0.924 . . . . 0.0 111.844 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -73.25 -33.89 65.54 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 120.803 0.335 . . . . 0.0 110.36 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.79 -42.9 94.42 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.555 0.742 . . . . 0.0 111.127 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.3 OUTLIER -66.0 -34.46 78.14 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.969 175.105 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.18 -27.8 68.67 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 112.324 176.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.486 HG13 HG21 ' A' ' 50' ' ' THR . 79.1 t -63.02 -48.88 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.245 0.618 . . . . 0.0 110.976 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -62.56 -35.09 78.37 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.673 0.789 . . . . 0.0 109.943 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -66.22 4.34 0.72 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.975 1.31 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -46.79 -15.21 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 125.519 1.528 . . . . 0.0 114.622 170.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -49.88 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.638 0 C-N-CA 125.346 1.458 . . . . 0.0 110.212 173.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.0 -10.43 20.55 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -169.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.4 t -72.68 -42.05 64.68 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -161.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.12 -29.85 3.06 Favored Glycine 0 CA--C 1.541 1.693 0 CA-C-O 120.401 -0.11 . . . . 0.0 112.986 -165.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -107.79 77.78 1.15 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 125.174 1.389 . . . . 0.0 108.027 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -49.14 133.1 16.07 Favored Pre-proline 0 N--CA 1.491 1.58 0 C-N-CA 123.925 0.89 . . . . 0.0 112.06 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -70.88 -178.63 2.87 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.709 2.273 . . . . 0.0 111.516 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 42' ' ' LEU . 3.8 mp -102.03 90.04 3.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -170.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -121.65 142.92 49.66 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.532 0.733 . . . . 0.0 110.177 -172.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 40.8 t -69.85 108.1 3.83 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.527 1.131 . . . . 0.0 109.746 174.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.55 48.41 1.3 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 122.84 1.305 . . . . 0.0 108.492 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.523 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -126.53 -9.92 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 125.748 1.619 . . . . 0.0 108.049 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 5.8 p 179.61 -123.5 0.0 OUTLIER 'General case' 0 C--N 1.348 0.543 0 N-CA-C 102.758 -3.053 . . . . 0.0 102.758 -162.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.572 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.82 143.81 11.23 Favored Glycine 0 C--N 1.308 -1.001 0 CA-C-O 117.342 -1.81 . . . . 0.0 108.978 159.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.4 t80 177.38 112.36 0.03 OUTLIER 'General case' 0 C--N 1.361 1.093 0 N-CA-C 103.052 -2.944 . . . . 0.0 103.052 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.486 HG21 HG13 ' A' ' 31' ' ' VAL . 2.7 m -119.19 148.19 43.38 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 118.712 0.687 . . . . 0.0 109.733 -171.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 87.8 m -152.21 169.06 23.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.509 1.124 . . . . 0.0 110.256 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.1 ttt180 -84.41 -36.42 22.42 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.503 0.721 . . . . 0.0 110.002 170.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -92.67 130.13 38.39 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.462 0.705 . . . . 0.0 109.306 -173.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -61.63 -41.44 97.49 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.659 0.784 . . . . 0.0 110.399 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -43.18 65.9 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.72 0.808 . . . . 0.0 112.276 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.0 m -51.94 -53.41 41.44 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.705 0.802 . . . . 0.0 112.434 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.58 ' H ' HD23 ' A' ' 57' ' ' LEU . 1.3 pt? -77.14 -28.55 54.3 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.745 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -61.75 -30.91 71.09 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 118.495 0.588 . . . . 0.0 112.18 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -79.82 -49.47 11.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -49.29 -36.82 21.91 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.4 ' SD ' ' N ' ' A' ' 62' ' ' LYS . 3.6 ppp? -71.02 -35.44 72.02 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.509 1.05 . . . . 0.0 110.309 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.4 ' N ' ' SD ' ' A' ' 61' ' ' MET . 30.1 ttmt -67.06 -28.33 68.11 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.54 0.736 . . . . 0.0 111.462 172.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -61.98 -32.23 72.65 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.091 0.556 . . . . 0.0 112.021 170.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 . . . . . 0 N--CA 1.496 1.859 0 C-N-CA 122.699 0.4 . . . . 0.0 111.558 170.562 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 73.0 p . . . . . 0 C--O 1.239 0.513 0 CA-C-O 120.912 0.387 . . . . 0.0 110.694 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.575 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 43.9 t -95.77 116.24 28.6 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -60.96 -15.72 34.65 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 122.062 -0.399 . . . . 0.0 111.578 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 mt -97.2 -37.6 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.23 0.612 . . . . 0.0 109.818 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 77' ' ' CYS . 14.1 p -160.05 56.85 0.36 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 121.019 0.438 . . . . 0.0 110.893 -178.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.575 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -25.48 74.26 0.0 OUTLIER Glycine 0 N--CA 1.492 2.392 0 C-N-CA 127.205 2.336 . . . . 0.0 118.265 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -88.46 -8.76 54.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.061 0.944 . . . . 0.0 111.682 171.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? 68.83 107.15 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.564 1.146 . . . . 0.0 110.298 173.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -110.59 168.05 9.76 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.044 0.538 . . . . 0.0 111.643 -172.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -59.66 -28.41 67.23 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.071 0.948 . . . . 0.0 112.297 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -163.66 161.72 23.79 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.351 0.661 . . . . 0.0 110.302 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 88' ' ' VAL . 25.0 pttm -65.8 -27.71 68.47 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.175 177.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -58.87 -39.68 82.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.575 0.75 . . . . 0.0 111.354 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.4 m -67.39 -31.72 72.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.234 0.613 . . . . 0.0 111.046 174.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.03 -40.91 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.732 0.813 . . . . 0.0 110.347 -177.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 84' ' ' LYS . 58.4 t -73.13 -36.16 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.293 1.037 . . . . 0.0 109.225 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 93' ' ' LYS . . . -65.63 -40.68 92.81 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.418 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -71.82 -33.93 68.91 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.633 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -70.37 -33.5 71.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.136 0.974 . . . . 0.0 108.77 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.79 74.33 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.18 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 29.2 mmtp -93.95 -48.49 6.23 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.962 0.41 . . . . 0.0 111.092 -172.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -90.34 -23.74 21.04 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.68 0.792 . . . . 0.0 111.239 -171.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 . . . . . 0 CA--C 1.572 1.796 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.447 -173.779 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 . . . . . 0 C--O 1.241 0.638 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.86 90.04 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.484 1.113 . . . . 0.0 111.692 172.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 64.9 m-85 -77.91 121.77 24.6 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.599 -176.793 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.419 HG22 ' H ' ' A' ' 17' ' ' GLU . 20.6 mm -112.81 117.18 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.139 -171.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.6 t -57.7 -23.65 52.78 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.527 1.131 . . . . 0.0 111.572 172.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.419 ' H ' HG22 ' A' ' 15' ' ' ILE . 42.3 tt0 115.93 -24.84 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.53 0 C-N-CA 127.287 2.235 . . . . 0.0 111.18 164.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -133.81 -48.65 0.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.809 0.814 . . . . 0.0 109.091 -177.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.1 p -114.92 64.02 0.68 Allowed 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.209 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -162.98 112.86 1.38 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.176 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -68.29 -45.17 73.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 169.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.58 148.97 2.03 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 123.772 0.829 . . . . 0.0 110.971 157.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -118.1 148.04 42.69 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -65.65 -25.54 67.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.4 m -147.02 156.93 43.42 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.964 0.411 . . . . 0.0 111.827 -175.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.3 p -59.11 -37.24 76.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.537 170.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.402 ' O ' HG23 ' A' ' 31' ' ' VAL . 15.2 m-70 -69.37 -39.26 78.14 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.867 0.867 . . . . 0.0 109.95 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -60.21 -51.06 71.19 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.52 1.128 . . . . 0.0 110.623 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -33.54 75.94 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.86 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.96 69.91 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.962 0.905 . . . . 0.0 112.207 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.566 HG21 ' HE ' ' A' ' 52' ' ' ARG . 25.8 t -68.32 -40.21 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.433 0.458 . . . . 0.0 110.338 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.82 -39.27 69.92 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.542 0.737 . . . . 0.0 109.69 175.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -64.08 -6.47 6.48 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.22 1.408 . . . . 0.0 111.614 -176.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.505 ' SD ' ' HB ' ' A' ' 50' ' ' THR . 25.9 ptt? -46.94 -15.19 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -54.4 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 125.226 1.41 . . . . 0.0 109.406 176.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.96 5.12 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 123.799 0.84 . . . . 0.0 112.98 -175.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -62.39 -35.78 80.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.747 0.419 . . . . 0.0 112.085 -168.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.57 -25.24 3.96 Favored Glycine 0 C--N 1.35 1.33 0 O-C-N 123.019 0.199 . . . . 0.0 112.719 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -128.47 89.22 2.86 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -53.56 112.73 3.97 Favored Pre-proline 0 N--CA 1.49 1.554 0 C-N-CA 123.946 0.898 . . . . 0.0 110.651 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.02 -67.35 0.04 OUTLIER 'Trans proline' 0 C--N 1.385 2.459 0 C-N-CA 122.682 2.255 . . . . 0.0 112.124 -173.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.5 ' HB3' HD21 ' A' ' 57' ' ' LEU . 85.4 mt -145.67 96.52 2.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.395 1.078 . . . . 0.0 108.458 -176.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -132.52 143.06 49.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.372 0.669 . . . . 0.0 110.545 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.4 t -63.91 110.53 2.13 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.335 1.054 . . . . 0.0 110.311 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -84.92 29.73 0.62 Allowed 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 123.845 0.858 . . . . 0.0 111.487 -178.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.35 -56.49 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.497 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.7 p -113.71 -117.67 0.32 Allowed 'General case' 0 C--O 1.239 0.507 0 N-CA-C 102.447 -3.168 . . . . 0.0 102.447 166.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.497 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.96 163.74 28.29 Favored Glycine 0 C--N 1.313 -0.696 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 156.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.6 t80 172.33 112.55 0.01 OUTLIER 'General case' 0 C--O 1.24 0.566 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.505 ' HB ' ' SD ' ' A' ' 34' ' ' MET . 3.4 m -114.3 138.05 51.01 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -173.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -144.97 162.06 37.84 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.761 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.566 ' HE ' HG21 ' A' ' 31' ' ' VAL . 38.0 ttm180 -76.98 -31.61 56.65 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.575 175.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.527 HE21 ' HB3' ' A' ' 55' ' ' ALA . 53.5 tt0 -106.71 122.16 45.8 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.701 0.8 . . . . 0.0 109.685 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -49.43 -47.59 47.98 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.63 1.172 . . . . 0.0 111.974 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.527 ' HB3' HE21 ' A' ' 53' ' ' GLN . . . -53.44 -31.85 47.21 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -63.43 -56.04 19.4 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.676 0.39 . . . . 0.0 111.371 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -75.06 -30.72 61.07 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.958 0.503 . . . . 0.0 111.646 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.02 -48.58 64.43 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.606 1.162 . . . . 0.0 112.776 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.439 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 8.8 m95 -77.06 -42.41 38.47 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 59.6 t60 -46.42 -41.36 13.63 Favored 'General case' 0 CA--C 1.569 1.678 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 168.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.524 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 75.0 mtm -71.41 -43.15 67.31 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 118.217 0.462 . . . . 0.0 111.562 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -60.31 -25.36 65.72 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 123.025 0.53 . . . . 0.0 111.855 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 32.6 mmmt -62.4 -38.59 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.924 0.49 . . . . 0.0 110.559 171.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.524 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 98.6 m-70 . . . . . 0 N--CA 1.496 1.856 0 C-N-CA 123.051 0.54 . . . . 0.0 111.085 172.154 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.8 p . . . . . 0 C--O 1.233 0.219 0 N-CA-C 109.148 -0.686 . . . . 0.0 109.148 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.617 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 0.9 OUTLIER -72.16 135.56 46.2 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 167.062 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.5 -27.07 65.82 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.975 0.91 . . . . 0.0 113.409 -174.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -113.08 -38.55 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 122.919 0.487 . . . . 0.0 110.308 -170.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.9 p -150.37 64.37 0.95 Allowed 'General case' 0 C--N 1.353 0.759 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -177.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.617 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -35.98 77.86 0.0 OUTLIER Glycine 0 C--N 1.355 1.627 0 C-N-CA 125.13 1.347 . . . . 0.0 116.407 167.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -68.41 -28.75 67.36 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.127 0.971 . . . . 0.0 110.989 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? 74.52 111.37 0.07 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 124.924 1.29 . . . . 0.0 110.387 -174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -116.6 155.82 28.06 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.17 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -29.97 66.29 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -135.4 150.96 50.02 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 122.82 0.448 . . . . 0.0 109.859 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -60.73 -30.4 69.96 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.977 0.911 . . . . 0.0 111.052 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -53.16 -45.8 68.63 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.828 0.705 . . . . 0.0 110.874 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.0 m -68.03 -30.46 69.7 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 t -74.56 -46.42 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.203 0.601 . . . . 0.0 110.024 -176.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -73.32 -37.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.664 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.65 -40.73 92.8 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 124.221 0.951 . . . . 0.0 109.354 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.99 -37.72 78.9 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.322 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -70.8 -41.19 71.94 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.804 0.841 . . . . 0.0 109.835 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.98 -28.72 68.49 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.273 0.629 . . . . 0.0 111.301 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -82.13 -53.53 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.539 1.136 . . . . 0.0 110.965 -174.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.03 -15.57 16.73 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.213 -166.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 . . . . . 0 CA--C 1.57 1.747 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -173.213 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.525 HH11 ' HA ' ' A' ' 24' ' ' LYS . 34.4 ttp85 . . . . . 0 N--CA 1.473 0.699 0 N-CA-C 106.821 -1.548 . . . . 0.0 106.821 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -141.13 97.38 3.16 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -169.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 81.7 m-85 -91.55 108.03 19.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.164 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.1 mm -109.15 149.74 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.628 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 25.4 t -94.01 -23.86 17.86 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 0.0 110.505 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 113.97 -27.18 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 128.533 2.733 . . . . 0.0 111.024 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -135.88 -51.66 0.73 Allowed 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.652 0.739 . . . . 0.0 109.927 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 p -113.34 57.27 0.68 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.833 -172.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.628 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -159.91 116.12 2.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.962 0.905 . . . . 0.0 109.578 165.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -68.34 -48.92 63.55 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.07 164.28 9.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.368 1.067 . . . . 0.0 109.627 160.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.483 ' HB2' ' HB2' ' A' ' 14' ' ' TYR . 88.5 m-85 -131.27 143.54 50.63 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.516 0.726 . . . . 0.0 109.815 167.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.525 ' HA ' HH11 ' A' ' 12' ' ' ARG . 25.9 ttpp -74.81 -24.83 58.69 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.071 0.948 . . . . 0.0 110.791 173.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -139.85 140.2 36.49 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.692 0.797 . . . . 0.0 110.336 -171.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.8 t -67.78 -25.88 65.83 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.234 172.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 26.4 m80 -70.44 -38.19 74.47 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.816 0.446 . . . . 0.0 110.799 174.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.66 -44.79 85.24 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 122.136 0.97 . . . . 0.0 109.617 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.64 -37.35 81.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.661 -1.609 . . . . 0.0 110.999 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.68 74.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.644 0.777 . . . . 0.0 112.23 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.689 HG13 ' HB ' ' A' ' 50' ' ' THR . 87.3 t -62.94 -44.74 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.649 0.78 . . . . 0.0 110.468 176.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -69.27 -38.02 78.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.84 0.856 . . . . 0.0 110.732 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.498 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 37.3 ttp180 -70.04 0.74 5.51 Favored 'General case' 0 C--O 1.21 -0.986 0 C-N-CA 124.319 1.047 . . . . 0.0 111.743 -172.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -46.43 -17.56 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 124.895 1.278 . . . . 0.0 114.319 172.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -54.17 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 124.427 1.091 . . . . 0.0 109.449 174.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -96.39 7.98 45.15 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.887 0.875 . . . . 0.0 111.658 -170.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 3.6 t -56.3 -64.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -156.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.6 35.69 75.02 Favored Glycine 0 N--CA 1.474 1.188 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.409 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 38.4 mt-10 -146.1 -38.01 0.24 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.567 1.547 . . . . 0.0 108.122 -169.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt 72.16 78.21 0.2 Allowed Pre-proline 0 C--N 1.358 0.95 0 C-N-CA 125.483 1.513 . . . . 0.0 109.9 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.43 170.01 19.09 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 122.82 2.347 . . . . 0.0 111.384 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.7 mt -111.48 140.62 45.92 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.674 0.79 . . . . 0.0 109.757 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 143.66 50.99 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -173.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.0 t -63.56 106.52 0.96 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.43 -29.18 33.98 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.909 1.283 . . . . 0.0 112.027 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.6 mm -74.29 -47.9 38.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 123.17 0.588 . . . . 0.0 109.985 -176.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.0 p -142.96 -89.36 0.13 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 120.586 0.231 . . . . 0.0 111.109 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.602 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -156.23 132.81 3.44 Favored Glycine 0 C--N 1.339 0.75 0 CA-C-O 116.838 -2.09 . . . . 0.0 109.709 -170.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.1 t80 168.1 112.91 0.01 OUTLIER 'General case' 0 C--N 1.353 0.752 0 N-CA-C 103.065 -2.939 . . . . 0.0 103.065 170.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.689 ' HB ' HG13 ' A' ' 31' ' ' VAL . 2.9 m -113.63 134.98 54.41 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -175.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 4.8 p -159.62 159.16 32.82 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 124.089 0.868 . . . . 0.0 110.891 176.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.46 -10.68 59.44 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.319 1.048 . . . . 0.0 111.252 176.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -103.01 109.31 20.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.392 1.077 . . . . 0.0 108.994 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -52.06 -42.47 63.17 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.467 0.707 . . . . 0.0 111.712 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.89 -41.73 64.63 Favored 'General case' 0 CA--C 1.556 1.186 0 O-C-N 124.698 1.249 . . . . 0.0 111.999 177.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.599 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 20.0 t -61.19 -52.63 64.01 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.643 0.777 . . . . 0.0 111.653 -173.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.478 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -74.25 -33.42 63.32 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.315 178.083 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -52.35 -42.29 63.77 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.826 0.851 . . . . 0.0 112.637 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -80.14 -38.49 31.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -177.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.8 t60 -48.26 -34.19 9.93 Favored 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 162.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.41 -35.14 70.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 172.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -61.03 -27.41 68.31 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 167.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 52.2 mtpt -68.98 -31.15 69.79 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.845 0.458 . . . . 0.0 110.243 173.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 . . . . . 0 N--CA 1.488 1.436 0 C-N-CA 123.41 0.684 . . . . 0.0 111.261 173.282 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 61.0 p . . . . . 0 CA--C 1.526 0.046 0 CA-C-O 121.302 0.572 . . . . 0.0 110.09 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.0 t -76.35 126.5 31.11 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.046 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.45 -27.83 69.38 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.526 0.603 . . . . 0.0 111.462 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.8 mt -88.24 -44.08 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.968 -170.785 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -131.69 -2.73 3.74 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 119.231 0.923 . . . . 0.0 112.335 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.17 31.72 56.51 Favored Glycine 0 C--N 1.362 2.001 0 N-CA-C 115.004 0.762 . . . . 0.0 115.004 174.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -62.61 -23.4 67.03 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.9 mmtm 77.8 118.62 0.06 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.826 1.25 . . . . 0.0 111.228 175.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -125.7 162.57 24.73 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.69 0.796 . . . . 0.0 111.832 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -72.3 -32.5 66.65 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.856 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -150.14 165.34 33.13 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-O 121.014 0.435 . . . . 0.0 111.395 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -56.13 -40.66 74.11 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.931 1.293 . . . . 0.0 111.528 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.87 -41.97 68.1 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.045 0.841 . . . . 0.0 111.503 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.0 m -66.13 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.647 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.9 t -76.3 -42.9 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 C-N-CA 123.728 0.811 . . . . 0.0 110.11 -174.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.7 -41.39 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.301 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.74 -36.58 80.83 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 113.966 -1.47 . . . . 0.0 109.742 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -68.25 -45.15 73.99 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.572 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 ttpt -70.16 -40.26 74.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.693 0.797 . . . . 0.0 109.715 -167.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.3 -30.38 66.6 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.061 177.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -102.76 -40.64 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.46 0.704 . . . . 0.0 111.742 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.2 t -85.95 -17.78 34.45 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.611 1.165 . . . . 0.0 111.158 -170.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 . . . . . 0 CA--C 1.567 1.629 0 C-N-CA 123.006 0.522 . . . . 0.0 111.043 -176.498 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.1 mpt_? . . . . . 0 N--CA 1.496 1.859 0 CA-C-O 121.398 0.618 . . . . 0.0 109.633 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -128.14 94.23 3.86 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.196 0.998 . . . . 0.0 108.817 -167.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.3 118.77 20.11 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 126.111 1.764 . . . . 0.0 109.077 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.643 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -114.64 151.13 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -173.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.648 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 2.2 t -81.61 -23.53 36.97 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.712 0.805 . . . . 0.0 111.281 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.643 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.1 tt0 85.87 -5.46 0.82 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.491 1.516 . . . . 0.0 110.288 174.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -134.76 -51.01 0.78 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.447 0.699 . . . . 0.0 109.311 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -144.27 79.37 1.61 Allowed 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.003 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -163.24 129.29 3.25 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.748 1.219 . . . . 0.0 109.293 164.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.469 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 35.3 ptt180 -66.61 -59.68 3.39 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.184 0.927 . . . . 0.0 108.731 175.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -176.22 146.45 0.66 Allowed 'General case' 0 C--N 1.354 0.777 0 C-N-CA 124.941 1.296 . . . . 0.0 108.519 169.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -119.34 139.13 52.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 173.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -89.42 0.38 56.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.313 0.245 . . . . 0.0 110.863 174.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 m -137.75 133.01 33.61 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.282 0.633 . . . . 0.0 110.052 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.8 p -61.79 -38.5 88.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.382 1.073 . . . . 0.0 111.526 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.481 ' O ' HG23 ' A' ' 31' ' ' VAL . 51.7 m-70 -62.48 -40.17 95.8 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.993 0.517 . . . . 0.0 111.47 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.79 -45.11 95.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.718 0.807 . . . . 0.0 110.175 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.42 -40.96 98.26 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.957 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.05 -30.32 71.27 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.227 0.611 . . . . 0.0 111.896 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 27' ' ' HIS . 81.2 t -65.98 -41.54 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.46 0.704 . . . . 0.0 110.465 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -68.44 -40.39 81.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.559 0.744 . . . . 0.0 110.83 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -65.09 -3.34 3.57 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.928 1.291 . . . . 0.0 112.128 -175.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -45.16 -24.41 0.25 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 125.193 1.397 . . . . 0.0 114.115 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.6 tp -87.2 -40.47 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 C-N-CA 124.323 1.049 . . . . 0.0 110.598 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -98.57 -19.04 17.82 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -172.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -62.03 -49.06 77.51 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -158.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.97 -31.1 3.75 Favored Glycine 0 C--N 1.338 0.665 0 CA-C-O 120.06 -0.3 . . . . 0.0 112.68 -164.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -111.17 78.85 1.15 Allowed 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 172.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -58.12 121.89 54.48 Favored Pre-proline 0 N--CA 1.478 0.957 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.099 -174.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -63.47 -86.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.741 2.294 . . . . 0.0 111.981 -172.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -145.55 100.65 3.47 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -142.18 126.95 18.11 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.371 0.668 . . . . 0.0 109.743 -176.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 t -64.67 109.4 2.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.872 1.269 . . . . 0.0 111.27 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -87.6 49.26 1.77 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.759 1.224 . . . . 0.0 110.085 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mm -133.9 -3.47 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.606 0 C-N-CA 125.528 1.531 . . . . 0.0 108.004 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.2 p 179.66 -133.44 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 102.745 -3.058 . . . . 0.0 102.745 -165.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.486 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.68 129.55 3.24 Favored Glycine 0 C--N 1.306 -1.117 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 161.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -176.79 113.29 0.1 Allowed 'General case' 0 C--N 1.354 0.803 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 -170.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 m -115.55 140.68 48.94 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 63.0 m -133.01 161.58 33.99 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.555 1.142 . . . . 0.0 110.875 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -97.24 -31.88 12.2 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.148 0.979 . . . . 0.0 109.462 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -97.28 130.71 44.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.152 0.981 . . . . 0.0 110.227 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -57.73 -44.03 85.7 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.57 1.148 . . . . 0.0 111.416 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.73 -40.56 69.39 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.591 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 t -56.92 -55.43 34.6 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.738 0.815 . . . . 0.0 112.302 -175.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.474 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.2 pt? -75.83 -27.94 58.07 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 119.332 -0.366 . . . . 0.0 111.673 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 61' ' ' MET . 6.3 t30 -58.92 -39.82 82.7 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.787 0.835 . . . . 0.0 112.744 175.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -79.69 -45.94 18.04 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 68.7 t60 -48.21 -37.73 16.61 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 168.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -72.09 -35.22 69.15 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 119.647 1.112 . . . . 0.0 110.759 178.105 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.45 -31.4 72.11 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.058 0.543 . . . . 0.0 111.277 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -58.54 -30.32 67.01 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.933 173.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.456 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 96.8 m-70 . . . . . 0 N--CA 1.49 1.549 0 C-N-CA 123.064 0.546 . . . . 0.0 111.798 175.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 77.2 p . . . . . 0 C--O 1.232 0.133 0 CA-C-O 121.541 0.686 . . . . 0.0 110.496 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.735 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 5.1 t -100.32 124.18 45.47 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 170.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -70.56 -5.4 28.78 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.246 0.475 . . . . 0.0 111.739 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.5 -32.13 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.725 0.81 . . . . 0.0 109.15 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.4 p -170.32 70.59 0.06 Allowed 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . 0.735 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -39.46 76.5 0.0 OUTLIER Glycine 0 N--CA 1.48 1.567 0 N-CA-C 117.672 1.829 . . . . 0.0 117.672 175.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -66.68 -21.87 66.09 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.185 0.994 . . . . 0.0 111.264 171.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm 70.86 103.2 0.06 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.987 1.315 . . . . 0.0 109.628 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.403 ' HB3' ' HB3' ' A' ' 86' ' ' SER . 70.2 m-85 -107.41 160.53 15.57 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.297 0.639 . . . . 0.0 111.55 -167.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.51 -38.66 81.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.361 1.065 . . . . 0.0 112.629 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -166.66 172.73 10.32 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 123.831 0.707 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -55.6 -34.57 64.98 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.284 1.433 . . . . 0.0 112.578 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -54.86 -45.72 74.6 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 123.801 0.688 . . . . 0.0 111.182 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.403 ' HB3' ' HB3' ' A' ' 81' ' ' PHE . 26.3 t -69.81 -30.83 68.45 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.728 0.642 . . . . 0.0 111.107 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.7 t -73.31 -44.61 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 0.0 109.98 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.43 -38.07 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 113.731 -1.577 . . . . 0.0 109.169 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.19 -38.48 82.06 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.772 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -66.67 -49.69 65.34 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.448 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -70.82 -39.3 73.11 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.031 0.532 . . . . 0.0 110.113 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.96 -23.91 67.36 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.081 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -99.23 -44.49 6.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 123.332 0.395 . . . . 0.0 111.425 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.9 t -82.14 -26.73 33.25 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.457 1.103 . . . . 0.0 111.204 -173.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 . . . . . 0 CA--C 1.558 1.254 0 C-N-CA 122.707 0.403 . . . . 0.0 111.49 -175.199 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 . . . . . 0 N--CA 1.475 0.799 0 CA-C-O 121.672 0.749 . . . . 0.0 109.194 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.453 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 6.6 p-10 -149.68 98.86 2.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.035 -170.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -76.97 119.74 21.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.618 -1.628 . . . . 0.0 109.663 174.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -105.03 149.18 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.777 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 1.4 t -83.6 163.39 20.39 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.611 0.72 . . . . 0.0 110.283 176.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 31.5 tt0 -58.4 -32.76 68.93 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.523 -1.671 . . . . 0.0 111.217 -176.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -138.4 -49.52 0.55 Allowed 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.097 0.559 . . . . 0.0 109.978 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.2 p -124.84 72.18 1.21 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.605 -169.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.777 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -141.65 135.09 29.59 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.983 150.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -69.19 -58.94 3.39 Favored 'General case' 0 CA--C 1.555 1.145 0 O-C-N 124.241 0.963 . . . . 0.0 109.483 168.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . -172.99 133.4 0.54 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 123.567 0.747 . . . . 0.0 111.083 170.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -114.35 130.75 56.69 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -80.29 3.73 20.02 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 118.44 0.564 . . . . 0.0 111.738 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . 0.429 ' HB3' ' ND2' ' A' ' 28' ' ' ASN . 16.7 t -137.4 134.88 36.42 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.138 0.975 . . . . 0.0 109.827 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.4 p -69.14 -28.83 66.8 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.832 0.853 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 31' ' ' VAL . 67.9 t60 -62.97 -44.29 96.46 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.176 0.59 . . . . 0.0 110.252 176.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.469 ' ND2' HH12 ' A' ' 52' ' ' ARG . 3.3 m-80 -53.7 -51.28 63.78 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.119 0.968 . . . . 0.0 111.464 177.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.8 tp -67.7 -34.86 77.72 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.287 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.43 88.26 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.056 0.543 . . . . 0.0 111.004 176.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.664 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 61.8 t -65.17 -36.67 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.553 175.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -65.28 -40.98 94.58 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.026 0.93 . . . . 0.0 110.75 174.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.472 ' HG2' ' HB2' ' A' ' 36' ' ' HIS . 17.2 ttt180 -75.08 9.74 1.83 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 123.907 0.883 . . . . 0.0 111.505 -174.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.538 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 25.7 ptt? -49.68 -27.47 4.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.307 1.443 . . . . 0.0 113.705 169.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . 0.412 HG22 ' H ' ' A' ' 35' ' ' ILE . 3.8 tp -86.82 -29.15 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.225 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.472 ' HB2' ' HG2' ' A' ' 33' ' ' ARG . 58.0 m-70 -99.9 -60.24 1.57 Allowed 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -167.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -104.35 24.99 10.7 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -149.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.95 43.26 34.68 Favored Glycine 0 N--CA 1.478 1.497 0 C-N-CA 119.872 -1.156 . . . . 0.0 113.496 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 34' ' ' MET . 11.1 mm-40 -146.75 114.99 6.64 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 124.592 1.157 . . . . 0.0 108.229 -166.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -112.4 94.0 25.2 Favored Pre-proline 0 N--CA 1.472 0.665 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 167.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.664 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 28.3 Cg_endo -58.32 -67.21 0.06 OUTLIER 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 123.543 2.829 . . . . 0.0 112.188 -174.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 54' ' ' LYS . 86.3 mt -146.23 90.88 2.0 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -136.48 135.6 38.72 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.794 0.437 . . . . 0.0 111.904 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.515 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 7.5 t -71.58 105.35 3.61 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.698 1.199 . . . . 0.0 109.725 171.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -93.27 49.49 1.41 Allowed 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.574 1.178 . . . . 0.0 110.185 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 3.1 mp -114.57 -55.31 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 169.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 21.3 p -112.7 -113.03 0.33 Allowed 'General case' 0 C--O 1.238 0.462 0 N-CA-C 103.997 -2.594 . . . . 0.0 103.997 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -148.32 154.63 25.98 Favored Glycine 0 C--N 1.313 -0.742 0 N-CA-C 108.626 -1.79 . . . . 0.0 108.626 152.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.9 t80 172.48 114.37 0.01 OUTLIER 'General case' 0 C--N 1.351 0.662 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -173.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.1 m -129.4 138.31 51.42 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 52' ' ' ARG . 52.0 t -136.36 167.13 21.91 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.131 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.469 HH12 ' ND2' ' A' ' 28' ' ' ASN . 16.8 tpp85 -70.44 -33.82 71.75 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.239 176.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -121.43 134.04 55.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.376 0.67 . . . . 0.0 109.918 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.516 ' HB2' HD22 ' A' ' 42' ' ' LEU . 5.5 ttpm? -59.29 -21.76 60.16 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.495 0.718 . . . . 0.0 111.374 174.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.98 -28.13 15.74 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.647 1.179 . . . . 0.0 112.582 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -77.52 -55.0 5.74 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.27 0.628 . . . . 0.0 112.358 175.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.575 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -75.86 -34.55 60.04 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -171.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 61' ' ' MET . 1.3 p-10 -55.51 -37.48 67.95 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.506 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 45.8 p-90 -86.04 -35.85 20.07 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 118.251 0.478 . . . . 0.0 111.02 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 65.8 t60 -48.26 -32.23 6.98 Favored 'General case' 0 CA--C 1.572 1.822 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 171.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.449 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 23.8 ptp -69.48 -32.19 70.94 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.935 -1.103 . . . . 0.0 112.35 170.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 39.3 ttmt -58.11 -29.17 65.28 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 122.921 0.488 . . . . 0.0 111.457 169.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 31.2 mmmt -63.61 -38.09 89.8 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.916 0.486 . . . . 0.0 110.61 175.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.3 m-70 . . . . . 0 N--CA 1.481 1.125 0 C-N-CA 123.116 0.567 . . . . 0.0 110.281 177.335 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.0 m . . . . . 0 C--O 1.235 0.317 0 N-CA-C 109.339 -0.615 . . . . 0.0 109.339 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 9.8 t -87.19 105.63 17.33 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -58.74 -8.79 1.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 8.4 mt -93.9 -48.05 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 123.553 0.741 . . . . 0.0 112.156 178.089 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 15.9 p -132.06 5.39 4.17 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.35 34.83 59.79 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 123.563 0.601 . . . . 0.0 114.366 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.438 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 8.1 tmtm? -65.21 -28.86 69.66 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.063 0.545 . . . . 0.0 111.712 -174.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt 71.08 116.62 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.658 1.183 . . . . 0.0 110.872 172.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.414 ' CZ ' ' HD2' ' A' ' 79' ' ' LYS . 89.5 m-85 -127.46 160.34 31.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.623 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.47 -40.14 95.14 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.91 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -136.59 154.59 50.64 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 123.277 0.631 . . . . 0.0 109.981 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -59.93 -31.19 69.62 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.347 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.55 -45.16 81.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.62 0.768 . . . . 0.0 110.714 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.5 m -67.87 -30.82 70.29 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 123.77 0.669 . . . . 0.0 111.776 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.29 -48.53 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 C-N-CA 123.431 0.692 . . . . 0.0 110.425 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.0 t -73.68 -35.07 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 109.657 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.36 95.42 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.282 173.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -72.81 -34.74 67.07 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.689 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -73.78 -36.81 65.1 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.316 0.647 . . . . 0.0 109.823 -176.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.38 -38.54 89.98 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.033 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -97.01 -46.85 6.03 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -169.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.3 t -80.28 -20.74 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.633 0.773 . . . . 0.0 110.673 -173.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 . . . . . 0 CA--C 1.561 1.399 0 C-N-CA 123.147 0.579 . . . . 0.0 109.532 -176.74 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 21.2 ptt180 . . . . . 0 N--CA 1.481 1.118 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -143.54 94.82 2.65 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.746 1.26 . . . . 0.0 108.786 -166.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -99.84 133.52 44.08 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 113.516 -1.675 . . . . 0.0 109.57 -174.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 17' ' ' GLU . 6.7 mm -115.18 149.49 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.603 0.761 . . . . 0.0 109.582 -166.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.62 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.8 t -85.49 -20.39 29.79 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.531 0.732 . . . . 0.0 109.979 174.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.703 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.7 tt0 85.95 -3.97 0.79 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 126.235 1.814 . . . . 0.0 111.19 171.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -135.87 -49.2 0.69 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -136.21 77.14 1.64 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.357 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.62 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -170.85 128.04 0.75 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.605 1.162 . . . . 0.0 109.394 163.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.418 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 34.1 ptt180 -68.86 -58.25 4.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.418 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -173.2 152.85 2.34 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 124.135 0.974 . . . . 0.0 109.616 164.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -125.94 152.05 46.15 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.558 1.143 . . . . 0.0 108.29 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -59.03 -30.31 67.93 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 m -143.21 156.11 44.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.269 0.628 . . . . 0.0 110.98 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.577 ' HA ' HD23 ' A' ' 29' ' ' LEU . 41.9 m -57.11 -36.52 70.73 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.608 171.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -74.13 -35.41 64.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.087 0.555 . . . . 0.0 110.732 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.78 -47.21 86.59 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.405 0.682 . . . . 0.0 110.467 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.577 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.2 OUTLIER -66.98 -28.99 68.71 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.828 0.851 . . . . 0.0 110.747 174.232 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.71 -27.52 69.27 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.936 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.11 -41.45 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 122.749 0.42 . . . . 0.0 110.212 173.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -64.92 -38.45 91.01 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.703 0.801 . . . . 0.0 110.222 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.48 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 24.9 ttt85 -70.03 5.95 1.42 Allowed 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 124.859 1.263 . . . . 0.0 111.723 -176.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.0 ptm -46.11 -18.4 0.05 Allowed 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 125.314 1.446 . . . . 0.0 113.574 171.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.98 -52.88 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.919 0 C-N-CA 125.403 1.481 . . . . 0.0 110.428 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.48 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -100.42 6.45 44.42 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.535 0.734 . . . . 0.0 112.65 -172.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.421 HG21 ' HA ' ' A' ' 40' ' ' LYS . 3.4 t -58.88 -55.4 35.58 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -163.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.08 -31.41 3.13 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-O 120.083 -0.287 . . . . 0.0 112.62 -171.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -86.75 -48.54 8.16 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.883 0.873 . . . . 0.0 110.886 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' HG21 ' A' ' 37' ' ' THR . 60.5 mttp 70.3 122.75 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 126.107 1.763 . . . . 0.0 111.429 -168.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.27 -170.84 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.217 0 C-N-CA 121.979 1.786 . . . . 0.0 110.679 164.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 54' ' ' LYS . 95.4 mt -92.38 98.22 11.35 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -122.46 130.15 52.77 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.389 1.076 . . . . 0.0 110.134 -167.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.463 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 21.1 t -69.0 107.05 2.98 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.33 170.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.49 27.28 0.44 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.581 1.152 . . . . 0.0 111.693 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.463 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 21.8 mm -118.82 -3.31 9.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.479 1.112 . . . . 0.0 108.773 -168.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.4 p 179.93 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.523 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 -169.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.26 135.47 5.24 Favored Glycine 0 C--N 1.309 -0.918 0 N-CA-C 107.142 -2.383 . . . . 0.0 107.142 158.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -179.36 111.86 0.05 Allowed 'General case' 0 C--N 1.346 0.431 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.2 m -128.71 146.52 50.86 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -166.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 t -157.48 179.04 9.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.595 -177.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -110.52 -3.43 16.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.409 0.684 . . . . 0.0 110.149 169.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -106.02 104.64 14.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 172.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.5 pttt -57.64 -33.54 68.39 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.622 0.769 . . . . 0.0 112.801 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.41 -41.73 69.63 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.758 0.823 . . . . 0.0 112.097 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.3 m -52.08 -52.87 48.46 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.088 0.955 . . . . 0.0 112.616 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.466 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -77.85 -31.49 51.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.607 0.763 . . . . 0.0 111.995 177.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.69 -44.0 97.06 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.575 0.75 . . . . 0.0 112.968 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -81.03 -36.84 30.04 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -51.57 -30.72 21.88 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.456 1.102 . . . . 0.0 113.683 165.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.435 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 28.5 ttt -71.6 -39.57 70.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.102 0.561 . . . . 0.0 111.357 173.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -58.77 -34.43 71.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.273 0.629 . . . . 0.0 110.654 168.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -64.19 -29.42 70.53 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.628 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 82.7 m-70 . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.882 -0.511 . . . . 0.0 111.794 172.815 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 58.1 p . . . . . 0 N--CA 1.451 -0.394 0 N-CA-C 108.562 -0.903 . . . . 0.0 108.562 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.9 t -70.69 114.03 8.37 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 169.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -60.12 -13.89 14.24 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -172.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mt -104.38 -31.41 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -175.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 19.4 p -136.2 -4.95 2.11 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.765 -1.209 . . . . 0.0 113.389 -178.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.05 33.75 85.26 Favored Glycine 0 C--N 1.347 1.185 0 C-N-CA 123.039 0.352 . . . . 0.0 113.381 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.541 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.0 tmtt? -65.76 -35.13 79.85 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.03 0.932 . . . . 0.0 112.103 -176.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? 73.67 120.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.816 1.246 . . . . 0.0 110.4 -176.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -128.56 162.42 27.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.913 0.885 . . . . 0.0 109.861 175.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 8.1 mm-40 -70.69 -28.3 64.66 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.437 0.695 . . . . 0.0 112.673 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HD3' ' HB2' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -144.39 151.22 38.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.122 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -66.2 -25.1 66.77 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.632 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.65 -28.29 65.76 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 49.4 m -67.48 -31.7 72.03 Favored 'General case' 0 C--N 1.359 1.012 0 O-C-N 122.952 0.157 . . . . 0.0 110.923 171.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.4 t -75.15 -47.69 34.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.002 0.921 . . . . 0.0 110.196 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 70.6 t -73.34 -35.94 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.081 1.352 . . . . 0.0 109.959 -174.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.89 95.33 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 86' ' ' SER . 2.3 t60 -71.41 -30.18 65.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.873 178.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.6 -41.0 69.47 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.412 1.085 . . . . 0.0 109.603 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.36 64.36 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.125 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -105.58 -42.03 5.31 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.219 0.608 . . . . 0.0 112.34 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.8 t -93.26 -23.08 18.64 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.096 0.958 . . . . 0.0 111.306 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 53.7 m-70 . . . . . 0 CA--C 1.57 1.732 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.057 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.4 ttt-85 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 122.563 1.173 . . . . 0.0 108.542 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -164.71 114.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -168.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -121.54 120.62 35.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.792 0.837 . . . . 0.0 110.715 -178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 43.0 mm -100.95 110.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.097 -177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.7 t -61.97 90.82 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 158.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 18.47 -59.44 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 129.101 2.96 . . . . 0.0 116.563 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -121.35 -39.28 2.69 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.474 -165.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.25 -23.36 19.35 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.32 125.88 35.3 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -170.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.432 ' CD ' ' H ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -69.62 -52.01 29.77 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.029 163.374 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -177.43 138.17 0.22 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 125.24 1.416 . . . . 0.0 108.568 160.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -105.02 151.81 23.5 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -63.29 -34.71 78.27 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.309 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 m -146.95 154.44 41.27 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 121.124 0.488 . . . . 0.0 111.817 -169.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 p -61.03 -45.31 95.3 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.72 1.208 . . . . 0.0 112.142 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -68.78 -35.63 77.29 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.26 -51.69 67.2 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.505 0.722 . . . . 0.0 111.106 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -37.11 85.12 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.984 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.06 -29.23 68.41 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 124.137 0.898 . . . . 0.0 112.532 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.99 -45.21 95.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.219 0.608 . . . . 0.0 110.972 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -35.83 70.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.333 0.653 . . . . 0.0 109.479 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.644 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 39.1 ttt85 -61.96 -8.08 4.68 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.348 1.459 . . . . 0.0 112.361 -175.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.41 ' HA ' ' HB ' ' A' ' 37' ' ' THR . 23.0 ptm -46.04 -12.55 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 -178.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -53.42 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 C-N-CA 124.587 1.155 . . . . 0.0 108.641 172.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.548 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -101.82 14.37 32.14 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.399 1.479 . . . . 0.0 112.435 -176.161 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.644 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 13.5 t -57.89 -70.47 0.13 Allowed 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -154.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.03 32.86 81.8 Favored Glycine 0 N--CA 1.479 1.541 0 CA-C-N 118.994 0.815 . . . . 0.0 111.099 -169.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.446 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 10.6 mm-40 -147.5 -42.31 0.17 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.517 1.927 . . . . 0.0 106.913 -172.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? 61.5 96.67 0.04 OUTLIER Pre-proline 0 C--N 1.356 0.878 0 C-N-CA 126.067 1.747 . . . . 0.0 112.245 174.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.07 -173.23 1.6 Allowed 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.4 2.067 . . . . 0.0 110.185 161.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -120.3 118.47 30.49 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.802 0.441 . . . . 0.0 110.064 -175.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -116.06 148.78 39.85 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.577 0.751 . . . . 0.0 109.664 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.8 t -66.37 107.74 2.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.475 0.71 . . . . 0.0 109.962 167.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -75.91 8.71 2.89 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.646 0.779 . . . . 0.0 112.893 -178.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.464 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 39.2 mm -88.77 -56.24 5.44 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.505 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.3 p -119.44 -107.76 0.37 Allowed 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 104.139 -2.541 . . . . 0.0 104.139 175.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.505 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.16 164.18 29.24 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 160.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.0 t80 167.47 112.61 0.01 OUTLIER 'General case' 0 C--N 1.353 0.725 0 N-CA-C 103.379 -2.822 . . . . 0.0 103.379 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m -117.1 135.31 53.84 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.577 0.703 . . . . 0.0 109.765 -165.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.4 t -151.89 164.4 37.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.837 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -81.57 -31.14 32.74 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.069 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -103.99 127.18 51.54 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.372 1.069 . . . . 0.0 109.487 -173.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -55.86 -30.21 61.14 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.723 0.639 . . . . 0.0 112.029 175.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.52 83.44 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.397 1.079 . . . . 0.0 112.901 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -59.97 -54.36 46.94 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.343 0.657 . . . . 0.0 111.674 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.5 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -75.43 -24.11 57.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 123.744 0.818 . . . . 0.0 112.013 177.605 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -52.0 -42.98 63.43 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.553 0.741 . . . . 0.0 112.751 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -79.67 -48.37 13.81 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 83.2 t60 -48.52 -39.98 25.2 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.418 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 0.0 OUTLIER -71.01 -37.53 72.63 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 119.991 1.268 . . . . 0.0 110.551 175.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -65.24 -26.35 68.07 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.532 0.733 . . . . 0.0 111.496 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -35.54 79.44 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 94.6 m-70 . . . . . 0 N--CA 1.485 1.311 0 C-N-CA 123.136 0.574 . . . . 0.0 111.659 178.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.544 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 68.8 p . . . . . 0 N--CA 1.465 0.317 0 N-CA-C 109.892 -0.41 . . . . 0.0 109.892 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 37.2 t -123.6 97.31 5.32 Favored 'General case' 0 C--O 1.2 -1.534 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -56.72 -14.83 3.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -169.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 mt -87.35 -22.87 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.749 0.419 . . . . 0.0 111.474 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.642 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.4 p -147.56 4.14 0.77 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 53.09 37.02 53.45 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.161 0.886 . . . . 0.0 114.72 -177.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.1 tmtt? -66.3 -37.91 86.5 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 111.646 -172.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 71.5 mmtt 72.25 117.02 0.05 OUTLIER 'General case' 0 C--N 1.362 1.15 0 C-N-CA 124.797 1.239 . . . . 0.0 110.11 176.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.413 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.6 m-85 -125.31 164.99 19.17 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.57 -39.51 94.57 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 114.408 -1.269 . . . . 0.0 111.54 176.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -145.8 155.83 43.18 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.021 0.528 . . . . 0.0 110.023 -177.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.9 pptp? -64.34 -24.42 67.64 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.102 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.52 -47.1 80.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.062 0.545 . . . . 0.0 110.484 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -65.81 -30.77 71.45 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.423 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 86.5 t -72.92 -49.26 40.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.714 0.805 . . . . 0.0 110.194 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.78 -35.37 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.963 1.305 . . . . 0.0 109.182 -174.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.52 -44.41 94.32 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.517 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.05 -35.0 66.62 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.42 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -69.83 -38.81 76.65 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.277 1.031 . . . . 0.0 109.244 -172.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.24 -23.07 66.35 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.459 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -91.94 -50.82 5.51 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 121.197 0.522 . . . . 0.0 110.423 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.7 t -85.12 -23.92 28.24 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.825 1.25 . . . . 0.0 111.795 -169.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.7 m-70 . . . . . 0 CA--C 1.562 1.439 0 C-N-CA 122.557 0.343 . . . . 0.0 111.715 -172.779 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 108.377 -0.972 . . . . 0.0 108.377 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 59.85 95.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.117 1.367 . . . . 0.0 111.707 -177.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.27 113.11 24.69 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -177.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.4 mm -105.54 157.05 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.22 0.608 . . . . 0.0 109.576 -167.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.622 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 23.4 t -90.85 12.21 20.12 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.679 0.391 . . . . 0.0 111.205 173.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 87.54 -38.88 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.761 1.624 . . . . 0.0 110.08 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -137.41 -55.26 0.69 Allowed 'General case' 0 C--N 1.351 0.664 0 C-N-CA 122.73 0.412 . . . . 0.0 110.028 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 p -94.82 58.86 2.31 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.622 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.14 142.24 4.94 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.003 0.921 . . . . 0.0 110.46 160.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 10.2 ptp180 -68.0 -58.55 4.34 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 118.982 -0.532 . . . . 0.0 109.621 167.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.419 ' N ' ' HG3' ' A' ' 21' ' ' ARG . . . 174.28 134.87 0.04 OUTLIER 'General case' 0 C--N 1.358 0.961 0 C-N-CA 125.738 1.615 . . . . 0.0 108.0 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -108.46 164.52 12.27 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -56.4 -44.53 80.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.934 1.294 . . . . 0.0 111.339 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.0 m -146.21 168.59 20.65 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.301 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.528 ' HA ' HD23 ' A' ' 29' ' ' LEU . 51.0 p -64.62 -39.24 93.37 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.275 1.03 . . . . 0.0 112.617 -176.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -75.13 -37.0 61.57 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.395 0.678 . . . . 0.0 110.909 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.49 -41.93 73.71 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.911 0.885 . . . . 0.0 110.581 167.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -72.8 -33.81 66.48 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.899 178.236 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.628 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -62.75 -28.23 69.83 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.336 1.055 . . . . 0.0 111.9 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.2 t -50.29 -46.65 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 123.834 0.709 . . . . 0.0 111.49 168.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -77.06 -45.66 26.34 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.349 171.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.628 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 56.8 ttt180 -79.04 40.21 0.4 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.289 1.435 . . . . 0.0 110.155 -170.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -60.7 -52.77 63.69 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 123.824 0.85 . . . . 0.0 112.405 -162.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.2 tp -85.16 -17.89 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.581 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 49.3 m-70 -84.33 -42.3 15.91 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 120.613 1.552 . . . . 0.0 109.734 -156.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.3 t -70.9 -27.36 63.74 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 114.768 -1.106 . . . . 0.0 113.405 -165.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.58 33.88 12.69 Favored Glycine 0 C--N 1.342 0.874 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.183 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -110.83 -30.56 7.5 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.285 1.034 . . . . 0.0 109.98 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.9 pttt 44.55 72.84 1.09 Allowed Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 126.323 1.849 . . . . 0.0 112.572 -171.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.72 147.41 94.75 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.508 2.139 . . . . 0.0 111.581 175.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 50' ' ' THR . 91.2 mt -80.64 137.12 36.32 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -171.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.456 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 61.7 tt0 -117.65 139.3 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -168.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.715 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 1.8 t -64.28 112.79 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.936 0.894 . . . . 0.0 110.79 173.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -82.02 26.63 0.51 Allowed 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.689 0.796 . . . . 0.0 112.773 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 25.7 mm -105.64 -53.17 7.02 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 169.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.542 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 27.3 p -118.5 -109.33 0.36 Allowed 'General case' 0 C--N 1.346 0.443 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 173.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.542 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.02 165.92 29.35 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 108.624 -1.79 . . . . 0.0 108.624 155.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.688 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 23.8 t80 175.61 111.7 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -105.64 125.58 51.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -171.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.5 t -143.13 165.8 26.42 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.343 0.657 . . . . 0.0 111.622 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -70.18 -42.72 72.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.903 1.281 . . . . 0.0 110.835 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -110.98 131.37 55.1 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.548 0.739 . . . . 0.0 110.525 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -50.86 -37.26 42.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.793 1.237 . . . . 0.0 111.447 172.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -36.95 52.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.254 1.022 . . . . 0.0 112.515 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.8 m -69.47 -55.97 8.74 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.451 0.301 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -41.82 45.03 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -173.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -50.25 -54.18 22.99 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.769 0.827 . . . . 0.0 111.77 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.536 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 58.6 m95 -78.27 -33.92 49.28 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.331 -172.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -45.1 -41.17 7.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 124.049 0.843 . . . . 0.0 112.617 163.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.715 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 33.6 mtm -61.85 -48.01 82.49 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 117.465 0.121 . . . . 0.0 110.892 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.79 -39.54 77.77 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.102 0.876 . . . . 0.0 111.014 176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 31.4 mmmt -59.42 -45.73 90.71 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 124.208 0.943 . . . . 0.0 110.221 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.483 1.197 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -172.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 32.6 p . . . . . 0 C--O 1.24 0.589 0 N-CA-C 109.215 -0.661 . . . . 0.0 109.215 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.0 t -86.91 124.29 32.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -62.68 -25.86 68.36 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.987 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -92.44 -42.99 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.013 0.525 . . . . 0.0 112.221 -172.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.14 8.4 2.94 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 119.628 1.104 . . . . 0.0 113.142 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.4 37.43 18.71 Favored Glycine 0 N--CA 1.483 1.797 0 N-CA-C 117.769 1.868 . . . . 0.0 117.769 165.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -68.54 -26.98 65.7 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.855 0.827 . . . . 0.0 113.047 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.0 OUTLIER 77.61 121.36 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.667 1.587 . . . . 0.0 110.263 -172.335 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -119.32 170.19 9.33 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.945 0.898 . . . . 0.0 110.554 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.688 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 1.7 mm-40 -68.93 -28.64 66.83 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.799 -175.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -162.58 165.77 25.54 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.935 0.894 . . . . 0.0 109.31 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -60.65 -37.39 81.38 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.106 0.962 . . . . 0.0 111.009 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.85 -37.85 88.91 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.195 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.5 m -66.01 -29.97 70.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.966 0.506 . . . . 0.0 111.146 177.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 75.8 t -73.68 -48.58 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.268 1.027 . . . . 0.0 110.237 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.0 t -73.61 -34.48 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.874 -175.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.2 86.35 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.27 174.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -72.46 -32.65 66.43 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.346 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -70.23 -36.68 74.68 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.255 1.022 . . . . 0.0 109.362 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.36 83.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.749 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -87.97 -47.76 8.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.386 -171.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.6 t -104.13 -6.23 21.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.994 0.917 . . . . 0.0 111.763 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 . . . . . 0 CA--C 1.57 1.736 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.687 176.848 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 . . . . . 0 N--CA 1.479 0.986 0 CA-C-O 121.799 0.809 . . . . 0.0 109.158 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -148.53 95.5 2.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.8 1.24 . . . . 0.0 107.747 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -93.92 102.58 14.68 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.419 -178.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.0 mm -101.75 104.83 16.94 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.605 -166.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 18' ' ' TYR . 7.6 t -60.04 92.95 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 160.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 32.23 -62.23 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 128.772 2.829 . . . . 0.0 115.502 166.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 16' ' ' CYS . 3.2 t80 -134.67 -41.9 0.77 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.616 0.767 . . . . 0.0 110.155 -175.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -97.79 34.59 1.85 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.181 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.37 122.54 26.52 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.783 0.433 . . . . 0.0 111.126 159.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -69.37 -53.01 21.67 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 168.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -174.69 125.8 0.29 Allowed 'General case' 0 C--N 1.362 1.141 0 C-N-CA 123.926 0.89 . . . . 0.0 109.868 163.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -96.82 146.49 24.87 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -67.05 -29.81 69.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.946 0.499 . . . . 0.0 111.164 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -162.59 158.21 23.07 Favored 'General case' 0 CA--C 1.557 1.241 0 CA-C-O 120.993 0.425 . . . . 0.0 111.158 -173.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.8 p -65.25 -31.06 72.02 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -74.42 -36.7 63.46 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.359 0.527 . . . . 0.0 111.043 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -58.72 -48.29 81.65 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.697 1.237 . . . . 0.0 109.606 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.23 -43.53 78.7 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.801 -2.0 . . . . 0.0 112.383 169.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -57.9 -29.42 65.07 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.801 0.84 . . . . 0.0 112.679 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 50' ' ' THR . 61.1 t -61.05 -46.82 95.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.488 0.715 . . . . 0.0 110.532 176.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -73.81 -39.61 63.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.86 0.864 . . . . 0.0 111.069 174.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.408 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 43.0 ttt180 -69.35 -1.93 9.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.685 1.194 . . . . 0.0 111.965 -173.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.543 ' SD ' ' NE2' ' A' ' 43' ' ' GLN . 24.9 ptt? -45.38 -16.5 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.985 1.714 . . . . 0.0 114.79 174.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -86.77 -56.89 4.75 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.706 0 C-N-CA 125.379 1.471 . . . . 0.0 110.046 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.83 6.43 36.59 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -172.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.66 HG21 ' HD3' ' A' ' 41' ' ' PRO . 5.2 t -62.15 -49.66 74.97 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -169.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.28 -30.33 3.71 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 119.917 -0.38 . . . . 0.0 112.735 -169.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -70.03 -16.47 63.16 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.087 0.955 . . . . 0.0 113.217 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.08 82.14 0.24 Allowed Pre-proline 0 CA--C 1.563 1.476 0 C-N-CA 125.279 1.431 . . . . 0.0 112.706 -176.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . 0.66 ' HD3' HG21 ' A' ' 37' ' ' THR . 2.1 Cg_endo -83.3 173.58 9.7 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.292 2.661 . . . . 0.0 110.482 172.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 mp -97.92 131.37 44.44 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -173.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' SD ' ' A' ' 34' ' ' MET . 33.4 tt0 -120.32 141.42 50.04 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.733 0.413 . . . . 0.0 110.503 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.7 t -64.65 108.53 1.73 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.645 0.778 . . . . 0.0 109.573 169.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.83 6.28 2.66 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.32 1.048 . . . . 0.0 112.644 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.594 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 mp -90.73 -51.59 11.6 Favored 'Isoleucine or valine' 0 C--N 1.354 0.802 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -174.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 25.0 p -119.94 -112.75 0.33 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.36 158.27 27.66 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 108.253 -1.939 . . . . 0.0 108.253 157.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.7 t80 172.04 110.46 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 102.216 -3.253 . . . . 0.0 102.216 -175.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 31' ' ' VAL . 2.7 m -119.64 137.12 54.08 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -167.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 8.1 p -160.11 155.93 25.96 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.994 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 2.68 45.05 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.515 175.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -105.21 103.99 13.63 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 124.548 1.139 . . . . 0.0 108.345 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -50.73 -45.36 58.61 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.373 0.669 . . . . 0.0 111.268 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.65 -39.78 68.37 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.424 1.077 . . . . 0.0 112.783 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.499 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 22.9 t -61.47 -54.9 37.34 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.231 0.612 . . . . 0.0 111.79 -174.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.473 ' H ' HD23 ' A' ' 57' ' ' LEU . 1.1 pt? -75.14 -35.91 61.63 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.793 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -50.66 -41.63 55.68 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.021 0.929 . . . . 0.0 112.733 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.433 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 93.7 m95 -80.67 -54.53 5.55 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.399 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -41.28 -46.63 3.26 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.4 ptm -61.52 -46.97 87.7 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -68.42 -36.58 79.28 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.489 0.661 . . . . 0.0 111.522 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 29.4 mmmt -67.05 -33.94 76.6 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.017 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.482 1.132 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 179.293 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 38.1 m . . . . . 0 CA--C 1.52 -0.195 0 CA-C-O 121.532 0.682 . . . . 0.0 111.446 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 6.6 t -103.72 118.1 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 167.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.56 -22.81 66.73 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.047 0.385 . . . . 0.0 111.377 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mt -84.24 -41.73 16.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 122.78 0.432 . . . . 0.0 111.499 -172.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.7 p -136.92 -0.61 2.28 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.3 39.15 96.83 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 114.613 0.605 . . . . 0.0 114.613 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -64.49 -38.0 89.49 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.016 0.526 . . . . 0.0 111.212 -176.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 74.64 114.81 0.06 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.449 1.499 . . . . 0.0 110.014 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 91.6 m-85 -122.19 163.63 19.23 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.302 0.641 . . . . 0.0 109.937 -179.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.99 -1.4 52.47 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -158.62 144.67 16.89 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.671 0.788 . . . . 0.0 108.919 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.5 mtpt -58.22 -27.52 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.459 1.104 . . . . 0.0 110.937 174.542 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -54.54 -44.7 73.06 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.544 0.738 . . . . 0.0 110.813 173.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -70.24 -29.04 65.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.509 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.27 -45.35 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 123.972 0.909 . . . . 0.0 110.494 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 88.5 t -71.44 -37.6 65.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.341 1.056 . . . . 0.0 109.147 -176.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.63 78.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.847 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -72.13 -33.89 68.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.449 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -73.59 -33.28 64.54 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.349 0.595 . . . . 0.0 109.482 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.58 71.54 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.016 174.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -87.96 -58.77 2.45 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-O 121.473 0.654 . . . . 0.0 111.448 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.5 t -91.78 -8.18 47.48 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.878 1.271 . . . . 0.0 111.554 -167.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 . . . . . 0 CA--C 1.564 1.514 0 C-N-CA 123.112 0.565 . . . . 0.0 111.084 179.256 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 . . . . . 0 CA--C 1.544 0.718 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -127.15 89.38 2.96 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -174.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 63.0 m-85 -93.09 113.75 26.09 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.197 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.77 HG22 ' H ' ' A' ' 17' ' ' GLU . 9.5 mm -119.69 158.67 21.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 124.562 1.145 . . . . 0.0 108.491 -170.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.63 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.9 t -104.39 -10.03 18.04 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.828 0.851 . . . . 0.0 110.572 176.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.77 ' H ' HG22 ' A' ' 15' ' ' ILE . 3.1 mp0 88.65 -16.49 0.3 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.745 2.018 . . . . 0.0 112.391 170.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -134.86 -51.54 0.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.9 p -122.67 74.2 1.18 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.698 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.63 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -164.13 146.23 8.99 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.58 0.705 . . . . 0.0 112.229 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -77.9 -171.26 2.2 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 113.831 -1.531 . . . . 0.0 108.979 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.61 125.24 30.96 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.476 ' HB3' ' HB2' ' A' ' 28' ' ' ASN . 67.9 m-85 -110.23 147.54 33.58 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.058 0.543 . . . . 0.0 110.654 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -58.62 -37.22 75.43 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.119 0.968 . . . . 0.0 112.38 175.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.6 t -147.59 156.05 42.42 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.061 0.458 . . . . 0.0 111.103 -167.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.2 p -57.02 -27.08 61.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.662 -1.153 . . . . 0.0 111.551 171.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 36.7 t60 -70.99 -41.04 71.49 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.945 0.498 . . . . 0.0 110.625 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 2.3 m-20 -60.75 -49.62 76.78 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.021 0.915 . . . . 0.0 110.209 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 tp -63.83 -35.56 81.02 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.45 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.95 -31.98 71.52 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 123.444 0.697 . . . . 0.0 112.443 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.502 HG13 ' HB ' ' A' ' 50' ' ' THR . 79.0 t -64.08 -49.4 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -60.07 -39.18 85.17 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.773 0.829 . . . . 0.0 110.913 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -67.13 2.09 1.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.07 1.348 . . . . 0.0 111.73 -175.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.9 ptp -44.97 -22.95 0.11 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.58 1.552 . . . . 0.0 113.482 172.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.11 -50.59 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.772 1.229 . . . . 0.0 110.042 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -98.26 6.44 47.4 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.162 0.585 . . . . 0.0 111.638 -171.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -58.84 -60.19 4.23 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -164.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.48 -32.19 0.99 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 122.929 0.3 . . . . 0.0 113.335 -168.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.17 -42.83 75.37 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.749 1.219 . . . . 0.0 110.16 171.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 68.4 100.76 0.04 OUTLIER Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.729 1.611 . . . . 0.0 111.091 -171.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.87 -162.81 0.11 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.815 2.343 . . . . 0.0 111.603 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 54' ' ' LYS . 43.7 mt -100.01 106.34 18.11 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -132.33 135.51 46.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.539 0.736 . . . . 0.0 110.236 -169.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 1.2 t -65.32 107.79 1.73 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.108 0.963 . . . . 0.0 110.805 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -87.96 56.38 3.85 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.899 0.857 . . . . 0.0 110.811 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mm -125.93 -54.35 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 164.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.5 p -119.37 -116.99 0.32 Allowed 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 176.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -146.15 164.07 28.33 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 155.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 8.1 t80 171.25 113.1 0.01 OUTLIER 'General case' 0 C--N 1.348 0.511 0 N-CA-C 101.794 -3.41 . . . . 0.0 101.794 -174.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.502 ' HB ' HG13 ' A' ' 31' ' ' VAL . 8.0 m -121.75 129.5 52.74 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -170.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.6 t -141.01 163.12 33.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.637 -175.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -76.47 -21.04 56.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.493 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -117.76 116.23 26.6 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.483 1.113 . . . . 0.0 109.636 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . 0.443 ' N ' HD13 ' A' ' 42' ' ' LEU . 63.4 tttm -57.61 -34.77 69.62 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.142 0.977 . . . . 0.0 111.801 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.65 70.97 Favored 'General case' 0 CA--C 1.554 1.122 0 O-C-N 123.846 0.716 . . . . 0.0 112.301 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -61.85 -55.27 31.63 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.745 0.418 . . . . 0.0 111.3 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -71.26 -27.93 63.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.133 0.573 . . . . 0.0 111.687 178.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -52.58 -44.12 65.72 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.721 0.808 . . . . 0.0 112.396 171.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -76.72 -45.83 27.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 63.8 t60 -45.94 -40.93 10.92 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 168.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.43 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 66.8 mtm -71.82 -37.4 70.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.384 -0.823 . . . . 0.0 112.624 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -56.89 -32.15 65.59 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 168.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -67.96 -42.39 81.0 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.4 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 84.7 m-70 . . . . . 0 N--CA 1.49 1.566 0 C-N-CA 123.235 0.614 . . . . 0.0 111.389 171.541 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.5 p . . . . . 0 C--O 1.238 0.493 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.42 115.58 7.21 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -61.24 -19.25 61.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.182 0.593 . . . . 0.0 111.707 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 mt -96.12 -42.97 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.232 0 C-N-CA 123.62 0.768 . . . . 0.0 112.149 -175.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . 0.607 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.8 p -135.29 -5.11 2.33 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.44 1.018 . . . . 0.0 113.24 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.57 32.25 77.57 Favored Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.102 0.382 . . . . 0.0 113.873 176.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.607 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 52.9 tttm -69.89 -15.8 63.13 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -170.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt 76.13 112.68 0.07 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 124.52 1.128 . . . . 0.0 111.933 167.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -133.87 148.62 51.28 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.598 0.759 . . . . 0.0 111.847 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.57 -18.48 65.02 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.907 1.283 . . . . 0.0 113.821 -174.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.488 ' HG3' ' H ' ' A' ' 86' ' ' SER . 0.3 OUTLIER -144.84 148.31 33.85 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.46 -29.99 71.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.658 0.783 . . . . 0.0 110.288 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -56.6 -41.67 77.42 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.295 170.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.488 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 43.3 t -69.02 -30.42 68.79 Favored 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 122.951 0.5 . . . . 0.0 110.944 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.56 -44.49 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.737 0.815 . . . . 0.0 109.745 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -74.13 -36.35 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.141 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.22 -40.44 94.11 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.936 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.97 -29.64 66.8 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.765 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -72.09 -40.79 67.98 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.466 0.65 . . . . 0.0 109.77 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.0 63.08 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.637 178.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -98.78 -51.69 3.82 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.373 1.069 . . . . 0.0 112.029 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.3 t -92.85 -14.03 28.26 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.858 1.263 . . . . 0.0 111.405 -169.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.4 m-70 . . . . . 0 CA--C 1.556 1.199 0 C-N-CA 122.835 0.454 . . . . 0.0 110.956 179.927 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 . . . . . 0 CA--C 1.546 0.798 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -125.92 83.92 2.22 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.514 -1.221 . . . . 0.0 107.909 -173.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -81.93 115.3 21.04 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.9 -1.5 . . . . 0.0 110.024 -175.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.418 HG22 ' H ' ' A' ' 17' ' ' GLU . 15.4 mm -105.31 137.49 34.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -175.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.654 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 43.5 t -80.93 -24.73 37.96 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.211 0.604 . . . . 0.0 110.256 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.418 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.4 tt0 117.5 -28.63 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 127.728 2.411 . . . . 0.0 110.541 167.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -133.06 -42.4 0.89 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.114 0.966 . . . . 0.0 108.587 -173.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 66.76 1.01 Allowed 'General case' 0 C--O 1.242 0.68 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.242 -178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.654 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.04 124.2 1.5 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.989 162.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -67.74 -52.73 34.01 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 169.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -178.05 132.11 0.15 Allowed 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.393 1.477 . . . . 0.0 108.575 163.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -100.17 135.2 41.96 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 170.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -73.79 -10.99 60.23 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.262 0.625 . . . . 0.0 111.375 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -146.91 134.99 21.54 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 122.751 0.42 . . . . 0.0 110.833 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.636 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.1 m -59.82 -34.82 73.57 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.432 1.093 . . . . 0.0 111.588 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -62.36 -44.81 95.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.045 0.938 . . . . 0.0 110.748 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -66.89 -42.53 85.35 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.739 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -62.68 -34.87 78.01 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.439 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.67 69.16 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 123.754 0.659 . . . . 0.0 111.985 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 52' ' ' ARG . 39.6 t -63.92 -47.76 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -62.87 -39.9 95.85 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.194 0.998 . . . . 0.0 110.534 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 41.8 ttt180 -68.62 5.94 0.95 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.41 1.084 . . . . 0.0 111.842 -173.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.412 ' HE2' ' HB ' ' A' ' 50' ' ' THR . 25.6 ptp -42.87 -20.8 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 126.512 1.925 . . . . 0.0 114.853 176.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.32 -58.46 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 108.637 178.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.44 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.54 10.52 37.03 Favored 'General case' 0 N--CA 1.501 2.113 0 C-N-CA 124.458 1.103 . . . . 0.0 113.137 -170.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.415 ' OG1' ' HB2' ' A' ' 39' ' ' GLU . 4.5 t -57.8 -65.12 0.69 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -164.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.67 36.4 91.24 Favored Glycine 0 N--CA 1.476 1.357 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.415 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 37.1 mt-10 -149.86 -34.77 0.17 Allowed 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.902 1.681 . . . . 0.0 107.781 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt 46.77 75.93 0.61 Allowed Pre-proline 0 C--N 1.371 1.539 0 C-N-CA 126.263 1.825 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.36 -74.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.382 2.33 0 C-N-CA 123.107 2.538 . . . . 0.0 111.842 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 51' ' ' CYS . 95.4 mt -145.49 98.94 3.22 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.443 ' HG2' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -129.85 141.76 50.78 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -168.444 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.6 t -66.1 102.9 0.87 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . 0.422 ' H ' ' CD ' ' A' ' 45' ' ' GLU . 0.9 OUTLIER -73.97 -1.47 19.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.828 0.851 . . . . 0.0 111.945 177.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.515 HD11 ' SD ' ' A' ' 61' ' ' MET . 3.4 mp -83.8 -55.6 6.91 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 N-CA-C 107.103 -1.444 . . . . 0.0 107.103 174.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 18.3 p -132.58 -97.92 0.3 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.396 176.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.476 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -155.46 131.19 3.0 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 116.906 -2.052 . . . . 0.0 109.078 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.0 t80 164.83 113.56 0.01 OUTLIER 'General case' 0 C--N 1.354 0.804 0 N-CA-C 102.402 -3.184 . . . . 0.0 102.402 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 43' ' ' GLN . 3.1 m -128.42 126.51 40.72 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 96.4 m -150.45 141.74 23.25 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.442 -175.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 31' ' ' VAL . 29.9 ptt180 -69.66 -12.19 61.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.588 0.755 . . . . 0.0 111.147 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -101.02 107.76 19.3 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.35 -41.77 29.51 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.127 1.371 . . . . 0.0 111.65 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.87 -29.48 59.99 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.68 -1.145 . . . . 0.0 113.023 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.2 m -69.41 -56.34 7.74 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.134 -0.354 . . . . 0.0 111.816 179.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.44 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -75.68 -48.49 21.78 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.215 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -55.89 -31.38 62.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.446 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 27.2 m95 -83.98 -39.59 19.53 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.305 178.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -45.88 -37.86 6.76 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.515 ' SD ' HD11 ' A' ' 46' ' ' ILE . 23.0 ttp -62.61 -47.03 85.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.754 0.822 . . . . 0.0 111.252 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.75 -36.97 80.26 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.538 0.735 . . . . 0.0 111.24 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 64.2 mttm -62.58 -33.94 75.97 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.624 0.769 . . . . 0.0 111.255 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.421 ' CD2' ' HA ' ' A' ' 61' ' ' MET . 3.1 p80 . . . . . 0 N--CA 1.476 0.854 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.263 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t . . . . . 0 C--O 1.237 0.41 0 CA-C-O 121.101 0.477 . . . . 0.0 110.359 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.2 t -89.12 118.81 29.11 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 105.944 -1.872 . . . . 0.0 105.944 168.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.41 -19.81 65.9 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-O 121.024 0.44 . . . . 0.0 111.501 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -88.15 -37.32 10.39 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.279 0 C-N-CA 123.029 0.532 . . . . 0.0 111.785 -173.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.3 p -150.33 17.07 0.83 Allowed 'General case' 0 C--N 1.377 1.778 0 CA-C-N 119.449 1.022 . . . . 0.0 113.393 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 49.35 46.48 35.81 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 117.286 1.675 . . . . 0.0 117.286 160.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.68 -45.1 88.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 117.313 0.557 . . . . 0.0 111.241 173.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 69.07 112.72 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.484 1.114 . . . . 0.0 109.447 -167.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -111.32 167.89 9.95 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.209 1.004 . . . . 0.0 110.625 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.29 -31.51 71.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.179 0.592 . . . . 0.0 112.473 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HG2' ' H ' ' A' ' 86' ' ' SER . 0.0 OUTLIER -139.7 155.59 47.28 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.068 0.461 . . . . 0.0 110.403 177.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -62.43 -31.14 71.8 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.305 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -59.28 -38.54 80.4 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.513 0.725 . . . . 0.0 110.592 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.411 ' H ' ' HG2' ' A' ' 83' ' ' LYS . 67.6 m -70.28 -29.63 66.44 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 122.764 0.426 . . . . 0.0 111.571 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.06 -43.8 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.422 0.689 . . . . 0.0 109.688 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 80.6 t -71.57 -38.26 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.955 1.302 . . . . 0.0 109.239 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.01 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.71 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -72.32 -40.91 67.13 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.479 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -70.69 -38.6 73.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.77 0.828 . . . . 0.0 109.362 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.62 -28.81 68.05 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.451 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -91.62 -45.07 8.67 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.872 0.869 . . . . 0.0 111.207 -173.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.5 t -94.08 -23.35 18.01 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.746 1.219 . . . . 0.0 111.191 -169.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 . . . . . 0 CA--C 1.569 1.677 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -176.388 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 . . . . . 0 CA--C 1.545 0.774 0 N-CA-C 107.906 -1.146 . . . . 0.0 107.906 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.66 80.98 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -169.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -81.97 104.23 12.18 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.842 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -113.38 157.59 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 124.286 1.034 . . . . 0.0 109.777 -171.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.9 t -119.75 37.15 4.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.267 1.427 . . . . 0.0 108.149 -173.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 53.17 -37.46 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 127.827 2.451 . . . . 0.0 117.144 -172.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -133.86 -48.84 0.81 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.899 0.88 . . . . 0.0 110.629 -167.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -113.5 29.98 7.58 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.954 -168.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.29 142.11 46.22 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.89 0.852 . . . . 0.0 111.825 167.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 21' ' ' ARG . 13.9 ptp180 -72.54 -114.53 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 113.363 -1.744 . . . . 0.0 108.178 164.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -137.2 124.41 21.75 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 161.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -109.1 136.6 48.33 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -87.98 0.71 55.57 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 t -146.26 140.4 26.48 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 122.885 0.474 . . . . 0.0 110.126 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.0 m -46.09 -56.77 5.16 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.361 1.465 . . . . 0.0 113.266 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 31' ' ' VAL . 93.5 m-70 -69.34 -33.54 73.26 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.677 0.791 . . . . 0.0 111.776 -175.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -51.32 -55.37 18.73 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.063 0.945 . . . . 0.0 111.446 175.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.38 -45.7 87.79 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 114.889 -1.05 . . . . 0.0 112.187 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.66 -27.52 50.37 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.606 0.763 . . . . 0.0 112.785 178.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 27' ' ' HIS . 63.1 t -64.98 -51.14 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.358 0.663 . . . . 0.0 110.417 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -61.57 -40.11 93.55 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.382 0.673 . . . . 0.0 109.831 175.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 39.4 ttt180 -67.26 4.71 0.88 Allowed 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.622 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -45.46 -17.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 125.708 1.603 . . . . 0.0 114.957 174.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.99 -59.69 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.43 0 C-N-CA 125.128 1.371 . . . . 0.0 109.213 176.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.44 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -102.05 9.35 40.43 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.132 0.973 . . . . 0.0 112.98 -171.065 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.5 t -58.53 -56.39 22.7 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.89 0.876 . . . . 0.0 113.247 -170.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.18 -32.07 3.08 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 119.835 -0.425 . . . . 0.0 112.544 -170.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.13 -37.27 69.49 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 123.729 0.812 . . . . 0.0 111.306 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 68.02 110.35 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.927 1.291 . . . . 0.0 111.599 -170.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.84 -164.65 0.28 Allowed 'Trans proline' 0 C--N 1.383 2.354 0 C-N-CA 122.551 2.167 . . . . 0.0 110.352 165.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.6 mt -117.12 104.25 11.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.233 0.613 . . . . 0.0 109.48 -177.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 24.3 tm0? -127.25 141.39 51.74 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.682 0.793 . . . . 0.0 109.077 -168.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 t -69.49 107.98 3.59 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.612 0.765 . . . . 0.0 111.648 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -55.93 -27.54 52.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.73 1.212 . . . . 0.0 113.312 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.18 -57.51 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 122.736 0.414 . . . . 0.0 109.919 -174.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.5 p -129.45 -88.44 0.51 Allowed 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -154.08 145.9 13.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 116.997 -2.002 . . . . 0.0 108.781 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' GLN . 20.1 t80 165.5 110.91 0.01 OUTLIER 'General case' 0 C--N 1.358 0.954 0 N-CA-C 102.302 -3.221 . . . . 0.0 102.302 166.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -118.85 136.3 54.1 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -174.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.526 ' SG ' HD22 ' A' ' 57' ' ' LEU . 25.7 p -157.33 -173.99 4.68 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.759 -176.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.75 13.38 7.43 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.739 0.815 . . . . 0.0 109.029 172.215 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -121.63 104.94 9.99 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.652 1.181 . . . . 0.0 108.303 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -55.97 -31.78 63.31 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.439 1.096 . . . . 0.0 112.918 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.03 -43.08 91.58 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.49 1.119 . . . . 0.0 111.903 174.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -61.25 -55.89 26.87 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.452 0.701 . . . . 0.0 112.187 -171.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.526 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -75.4 -27.37 59.03 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.576 178.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -50.21 -44.97 53.4 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -80.79 -37.77 29.66 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 122.358 -0.214 . . . . 0.0 110.596 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 63' ' ' LYS . 83.1 t60 -48.5 -43.12 34.77 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.9 ptm -72.66 -33.84 66.84 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 119.218 0.917 . . . . 0.0 112.285 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -28.01 64.61 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.403 0.681 . . . . 0.0 111.183 168.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 60' ' ' HIS . 28.6 mtpp -72.39 -36.79 68.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.451 0.7 . . . . 0.0 110.364 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 . . . . . 0 N--CA 1.491 1.598 0 C-N-CA 123.507 0.723 . . . . 0.0 111.437 177.026 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.5 p . . . . . 0 C--O 1.237 0.419 0 N-CA-C 108.093 -1.077 . . . . 0.0 108.093 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.51 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 6.2 t -67.39 122.91 18.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 169.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -53.51 -26.86 22.6 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 7.8 mt -109.42 -25.94 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.566 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -171.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 p -140.37 5.23 2.04 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-N 120.474 1.488 . . . . 0.0 113.258 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 51.88 42.86 54.27 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 114.695 0.638 . . . . 0.0 114.695 174.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.51 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 3.8 tmtp? -65.51 -39.01 91.34 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -176.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 76.58 122.59 0.05 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 125.065 1.346 . . . . 0.0 111.408 -174.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.5 m-85 -135.68 148.62 48.99 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.123 1.369 . . . . 0.0 108.444 176.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.8 -19.27 65.71 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -174.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.35 140.7 47.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 124.418 1.087 . . . . 0.0 108.14 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -58.88 -27.85 65.58 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.266 1.026 . . . . 0.0 110.653 175.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -56.88 -47.14 81.14 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.346 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.7 m -67.43 -27.68 67.26 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 122.431 0.292 . . . . 0.0 111.702 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t -71.22 -44.5 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.425 0.69 . . . . 0.0 110.098 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 79.5 t -73.78 -38.18 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.846 1.258 . . . . 0.0 109.592 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.01 96.23 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.521 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -73.32 -38.56 65.76 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.073 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -72.57 -37.71 68.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.963 0.505 . . . . 0.0 110.947 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.74 -30.39 69.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.103 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -90.15 -46.31 8.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.835 0.854 . . . . 0.0 111.643 -171.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 42.4 t -88.16 -19.04 27.48 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.463 1.105 . . . . 0.0 110.652 -172.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 . . . . . 0 CA--C 1.557 1.225 0 C-N-CA 123.649 0.78 . . . . 0.0 109.246 -176.615 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.477 0.895 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.508 ' HA ' ' HB1' ' A' ' 22' ' ' ALA . 15.8 m-20 -121.99 86.09 2.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.52 -162.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -93.64 111.6 23.31 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.498 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.7 mm -108.35 145.67 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.558 -167.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.607 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 39.2 t -98.64 44.29 1.04 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 55.86 -40.53 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.226 2.61 . . . . 0.0 115.822 -172.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -134.94 -43.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.991 1.316 . . . . 0.0 109.414 -165.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -117.69 53.61 0.93 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.696 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.607 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -154.22 127.49 8.46 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.992 158.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -58.44 3.94 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 171.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.508 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -170.47 127.37 0.79 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.38 0.672 . . . . 0.0 110.867 164.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.66 157.72 16.75 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.443 0.697 . . . . 0.0 109.13 171.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -59.59 -36.08 75.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.156 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.2 m -145.75 155.85 43.22 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.223 0.535 . . . . 0.0 111.068 -176.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 p -59.03 -34.51 71.99 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.979 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -73.74 -33.16 64.21 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.269 0.628 . . . . 0.0 110.601 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.15 -50.94 69.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.278 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.403 HD13 ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -63.49 -33.14 74.92 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.374 0.67 . . . . 0.0 111.406 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.467 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -53.75 -27.51 28.99 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.425 1.078 . . . . 0.0 112.198 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 89.6 t -64.61 -48.06 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.864 0.865 . . . . 0.0 111.347 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.88 -37.84 82.28 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.638 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 52.4 ttt85 -62.64 -3.43 1.49 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.718 1.607 . . . . 0.0 112.615 -177.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 20.8 ptt? -45.06 -16.19 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.4 tp -85.51 -51.3 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 C-N-CA 125.358 1.463 . . . . 0.0 110.027 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.638 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -104.6 11.71 33.9 Favored 'General case' 0 N--CA 1.508 2.472 0 C-N-CA 125.158 1.383 . . . . 0.0 112.996 -178.311 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.623 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 7.1 t -57.95 -55.05 39.88 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -161.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.05 36.69 91.08 Favored Glycine 0 N--CA 1.473 1.164 0 N-CA-C 112.025 -0.43 . . . . 0.0 112.025 -171.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 33.7 mt-10 -158.82 -58.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -168.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 76.58 97.45 0.04 OUTLIER Pre-proline 0 C--N 1.352 0.708 0 C-N-CA 126.824 2.05 . . . . 0.0 111.504 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.33 172.16 12.71 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 122.508 2.139 . . . . 0.0 110.915 164.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -89.34 138.51 31.37 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -139.39 136.79 35.08 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.242 0.339 . . . . 0.0 110.277 -171.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.548 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 3.9 t -70.56 106.39 3.45 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.875 0.87 . . . . 0.0 109.433 175.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.33 16.65 1.23 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.834 0.854 . . . . 0.0 112.646 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.548 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 3.5 mp -94.53 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.351 0.656 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.515 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 23.7 p -116.32 -108.38 0.37 Allowed 'General case' 0 C--O 1.24 0.571 0 N-CA-C 104.206 -2.516 . . . . 0.0 104.206 172.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.515 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.09 159.85 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 108.593 -1.803 . . . . 0.0 108.593 155.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 15.4 t80 174.08 111.16 0.02 OUTLIER 'General case' 0 C--N 1.353 0.737 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.0 m -119.73 135.25 54.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -171.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.8 t -157.31 157.96 35.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.728 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.476 ' HD2' ' N ' ' A' ' 53' ' ' GLN . 2.2 ppt_? -78.47 -21.82 48.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.526 -1.215 . . . . 0.0 111.677 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.476 ' N ' ' HD2' ' A' ' 52' ' ' ARG . 8.0 tp60 -98.62 115.84 29.52 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -174.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.22 -34.27 63.8 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 176.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.98 -41.43 71.19 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 124.266 0.979 . . . . 0.0 111.85 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.2 m -57.42 -56.48 21.31 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.274 0.63 . . . . 0.0 112.174 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.568 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.2 pt? -76.29 -27.62 56.7 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.048 0.539 . . . . 0.0 111.969 177.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -50.4 -46.79 56.47 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 123.616 0.766 . . . . 0.0 112.59 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -81.02 -46.06 15.62 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.542 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 78.6 t60 -45.53 -43.09 11.59 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.6 ptm -63.1 -39.76 95.64 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 118.667 0.667 . . . . 0.0 111.459 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.86 -24.92 64.4 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 122.827 0.451 . . . . 0.0 111.625 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt -63.3 -29.95 71.18 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.5 0.32 . . . . 0.0 110.693 171.857 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 . . . . . 0 N--CA 1.494 1.746 0 C-N-CA 124.083 0.953 . . . . 0.0 112.106 178.018 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.7 m . . . . . 0 N--CA 1.473 0.676 0 N-CA-C 109.91 -0.404 . . . . 0.0 109.91 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.414 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 36.2 t -96.68 124.09 40.56 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 162.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . 0.406 ' OD1' HG13 ' A' ' 76' ' ' ILE . 14.7 p30 -62.45 -20.42 64.52 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . 0.406 HG13 ' OD1' ' A' ' 75' ' ' ASN . 7.2 mt -104.11 -37.05 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.8 p -134.62 13.09 3.74 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 119.62 1.1 . . . . 0.0 113.007 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 50.36 32.83 23.04 Favored Glycine 0 C--N 1.358 1.753 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 171.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.414 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 8.3 tmtm? -63.69 -35.17 79.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.889 0.876 . . . . 0.0 112.57 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.8 mptp? 75.09 115.61 0.06 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.384 1.074 . . . . 0.0 109.948 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 96.2 m-85 -124.22 154.6 39.92 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.769 0.827 . . . . 0.0 111.475 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.43 -41.26 98.58 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.434 1.094 . . . . 0.0 111.354 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.549 ' HB2' ' H ' ' A' ' 86' ' ' SER . 35.4 mtpt -121.61 144.59 48.66 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 123.823 0.849 . . . . 0.0 108.747 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . 0.412 ' O ' HG23 ' A' ' 88' ' ' VAL . 52.3 mtmt -65.03 -31.21 72.33 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . 0.424 ' HB3' ' HE2' ' A' ' 83' ' ' LYS . 33.1 t70 -54.61 -46.0 73.76 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.387 1.075 . . . . 0.0 110.578 170.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.549 ' H ' ' HB2' ' A' ' 83' ' ' LYS . 19.7 m -62.53 -32.44 73.38 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 123.336 0.397 . . . . 0.0 111.993 176.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 45.2 t -74.62 -45.03 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.128 0.571 . . . . 0.0 110.113 -175.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 84' ' ' LYS . 99.3 t -70.92 -37.69 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.45 1.1 . . . . 0.0 109.29 -175.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.14 -38.43 82.16 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.673 -1.148 . . . . 0.0 109.511 177.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -73.06 -33.83 65.89 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.603 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -73.69 -45.75 50.45 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.199 0.599 . . . . 0.0 110.35 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.11 -21.0 66.33 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.672 0.789 . . . . 0.0 111.825 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -100.28 -49.96 4.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.995 0.918 . . . . 0.0 111.982 -175.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 28.6 t -99.81 -4.35 30.7 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.189 0.996 . . . . 0.0 111.427 -168.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 54.0 m-70 . . . . . 0 CA--C 1.568 1.651 0 C-N-CA 124.05 0.94 . . . . 0.0 110.804 179.681 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 . . . . . 0 N--CA 1.485 1.296 0 CA-C-O 122.219 1.009 . . . . 0.0 109.803 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . 0.502 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 4.7 m-20 -134.72 93.72 3.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.704 1.202 . . . . 0.0 108.362 -167.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -79.36 113.59 17.62 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.244 1.418 . . . . 0.0 109.948 177.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.8 mt -109.6 134.04 52.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 C-N-CA 123.585 0.754 . . . . 0.0 110.338 -175.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 9.9 t -80.16 103.01 9.74 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 159.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.97 -15.01 7.47 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.613 1.165 . . . . 0.0 112.834 -168.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.93 -40.16 5.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.005 0.522 . . . . 0.0 110.485 -171.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -141.8 48.84 1.6 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.356 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . 0.485 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -155.54 148.28 24.21 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 163.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . 0.415 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 10.5 ptp180 -71.86 -72.49 0.22 Allowed 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.785 168.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . 0.502 ' HB1' ' HB3' ' A' ' 13' ' ' ASP . . . -171.15 154.63 4.1 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.234 1.013 . . . . 0.0 109.696 172.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -131.72 143.14 50.05 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.523 0.729 . . . . 0.0 109.335 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.17 -7.67 50.44 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.7 m -149.9 152.85 35.7 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.231 0.612 . . . . 0.0 110.395 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.0 t -61.5 -34.39 75.43 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.7 0.8 . . . . 0.0 111.726 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -73.28 -37.62 66.19 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.766 0.426 . . . . 0.0 110.788 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.59 -46.99 80.52 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.953 0.883 . . . . 0.0 109.927 173.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 tp -62.43 -39.12 92.27 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.592 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -54.33 -28.31 41.79 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.704 0.802 . . . . 0.0 112.496 176.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.0 t -63.73 -43.73 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.11 0.964 . . . . 0.0 111.185 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -70.5 -44.46 67.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.685 0.755 . . . . 0.0 110.391 170.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.571 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 49.7 ttp180 -70.87 4.43 2.58 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.059 -171.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . 0.422 ' O ' HG21 ' A' ' 50' ' ' THR . 19.8 ptt? -44.82 -20.4 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.184 1.394 . . . . 0.0 114.079 170.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -47.13 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 125.434 1.494 . . . . 0.0 109.346 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -101.19 -11.34 19.61 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -172.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 33' ' ' ARG . 4.5 t -60.1 -41.88 93.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -152.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.8 39.6 89.87 Favored Glycine 0 C--N 1.347 1.17 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.646 -178.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.6 -80.74 0.52 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -171.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 164.05 93.54 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.336 1.854 . . . . 0.0 109.231 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -97.13 -155.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 124.044 3.162 . . . . 0.0 111.08 173.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.3 mt -93.28 83.25 4.58 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -118.97 136.06 54.29 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.745 -171.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.723 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 8.3 t -68.95 106.72 2.84 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.166 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -93.6 53.43 1.86 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.645 1.212 . . . . 0.0 108.056 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.723 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -134.28 -7.14 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 125.938 1.695 . . . . 0.0 108.978 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 13.1 p -178.68 -118.09 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 103.733 -2.691 . . . . 0.0 103.733 -168.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.69 134.68 4.84 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 161.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.8 t80 178.1 117.99 0.04 OUTLIER 'General case' 0 C--N 1.351 0.653 0 N-CA-C 102.481 -3.155 . . . . 0.0 102.481 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 34' ' ' MET . 6.8 m -124.57 147.4 48.47 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.213 0.915 . . . . 0.0 110.141 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.532 ' SG ' HD22 ' A' ' 57' ' ' LEU . 16.2 p -148.9 179.14 8.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.016 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.35 23.4 6.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.135 1.374 . . . . 0.0 108.142 177.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -146.52 118.2 8.07 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.298 -167.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 -47.22 71.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.494 1.118 . . . . 0.0 113.094 -175.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.36 -33.25 70.94 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.0 m -63.65 -55.42 23.69 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.532 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -76.72 -26.35 54.55 Favored 'General case' 0 C--N 1.357 0.9 0 CA-C-N 118.09 0.405 . . . . 0.0 111.33 176.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.58 -49.61 72.28 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 173.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -79.19 -33.38 43.93 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.517 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 85.9 t60 -54.79 -38.51 67.39 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 167.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -31.25 62.57 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 120.127 1.33 . . . . 0.0 110.268 174.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.2 ttpp -61.21 -27.78 68.68 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.411 0.684 . . . . 0.0 111.709 167.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 6.4 mmpt? -63.3 -44.64 94.44 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 123.155 0.582 . . . . 0.0 110.864 169.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 . . . . . 0 N--CA 1.491 1.599 0 C-N-CA 123.306 0.643 . . . . 0.0 111.107 172.112 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t . . . . . 0 N--CA 1.451 -0.388 0 N-CA-C 108.292 -1.003 . . . . 0.0 108.292 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . 0.451 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 17.5 t -72.61 122.35 21.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 165.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -57.5 -27.04 62.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.186 0.994 . . . . 0.0 112.33 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.1 mt -94.84 -51.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.558 -174.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.0 p -128.82 11.24 6.1 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 119.455 1.025 . . . . 0.0 112.724 -172.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.81 41.69 28.07 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 114.68 0.632 . . . . 0.0 114.68 172.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.451 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 6.4 tmtm? -66.02 -41.83 90.46 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -177.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 12.4 mptt 72.77 121.57 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.85 1.26 . . . . 0.0 110.771 -176.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -126.39 162.75 24.83 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.242 1.017 . . . . 0.0 111.378 -178.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -69.19 -18.73 63.95 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HG3' ' H ' ' A' ' 86' ' ' SER . 26.0 pttm -147.32 148.63 31.58 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.44 -25.22 67.91 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.326 0.65 . . . . 0.0 110.759 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -61.29 -38.11 85.64 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.349 0.66 . . . . 0.0 110.76 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.447 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 70.8 m -68.98 -30.0 68.33 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.83 0.452 . . . . 0.0 111.1 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 93.7 t -72.39 -44.32 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 C-N-CA 123.475 0.71 . . . . 0.0 109.999 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 68.1 t -72.27 -37.86 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.295 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.08 -37.3 85.46 Favored 'General case' 0 C--N 1.35 0.601 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.615 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -71.7 -31.63 66.96 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.068 0.947 . . . . 0.0 111.245 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -71.47 -37.66 71.32 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.58 0.705 . . . . 0.0 109.103 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.62 -27.47 61.29 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.548 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -88.38 -52.36 5.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.066 0.946 . . . . 0.0 111.183 -174.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.9 t -97.32 -16.49 20.26 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.053 0.941 . . . . 0.0 110.983 -167.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 . . . . . 0 CA--C 1.571 1.771 0 CA-C-O 118.029 -0.986 . . . . 0.0 113.038 -177.878 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 . . . . . 0 N--CA 1.479 1.0 0 CA-C-O 121.746 0.784 . . . . 0.0 108.949 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -132.38 84.28 2.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -170.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.96 118.0 31.73 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 124.989 1.315 . . . . 0.0 109.074 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . 0.555 HG22 ' H ' ' A' ' 17' ' ' GLU . 14.7 mm -125.29 156.61 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -169.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . 0.499 ' HB2' HD11 ' A' ' 29' ' ' LEU . 28.5 t -91.31 12.37 20.61 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.867 0.867 . . . . 0.0 110.285 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.555 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.8 mp0 88.21 -38.22 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.9 2.08 . . . . 0.0 110.705 169.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -139.17 -52.94 0.56 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.379 0.609 . . . . 0.0 109.993 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.8 p -98.52 70.5 1.96 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.218 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -148.97 -172.63 4.16 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 163.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -112.57 -104.5 0.39 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 175.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.76 134.05 22.99 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 161.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -118.26 165.33 13.96 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.572 0.749 . . . . 0.0 109.576 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -103.06 10.33 38.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.747 0.819 . . . . 0.0 111.045 177.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -169.01 139.74 2.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.056 0.943 . . . . 0.0 109.936 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.8 p -73.61 -37.47 65.39 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.182 0.993 . . . . 0.0 110.956 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.35 -35.13 73.37 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.526 177.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' VAL . 55.6 t30 -59.12 -54.18 49.9 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.456 0.646 . . . . 0.0 109.97 170.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -54.66 -30.05 54.2 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.46 1.504 . . . . 0.0 112.439 178.239 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.71 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -52.71 -24.29 8.37 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.455 HG22 ' O ' ' A' ' 28' ' ' ASN . 32.5 m -53.47 -49.12 56.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 170.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -74.94 -46.8 33.19 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.594 0.711 . . . . 0.0 109.273 172.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.71 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 19.2 ttt180 -76.82 41.87 0.29 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.615 1.566 . . . . 0.0 109.428 -173.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -66.79 -57.26 7.42 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.188 -163.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.4 tp -68.27 -26.98 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 168.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.568 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 43.1 m-70 -79.45 -34.86 41.17 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.094 1.77 . . . . 0.0 108.736 -158.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t -70.55 -36.58 73.74 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.268 -166.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.04 -30.71 9.84 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.734 -0.481 . . . . 0.0 112.339 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -46.38 -39.07 9.79 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.812 1.245 . . . . 0.0 114.027 170.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 58.39 87.37 0.14 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.549 1.14 . . . . 0.0 111.535 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.46 -179.48 4.12 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.097 1.865 . . . . 0.0 111.276 166.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.7 mt -111.92 130.72 55.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -111.93 138.03 49.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.174 0.59 . . . . 0.0 109.952 -174.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.447 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 3.5 t -63.31 116.9 5.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.05 0.94 . . . . 0.0 110.231 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.08 33.04 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.945 1.298 . . . . 0.0 112.356 -171.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.9 mm -133.66 -7.0 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 125.074 1.349 . . . . 0.0 108.679 -172.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.536 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 0.8 OUTLIER 174.05 -139.39 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 -160.593 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.536 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -143.46 135.9 6.65 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 108.22 -1.952 . . . . 0.0 108.22 172.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 31.5 t80 179.12 115.23 0.04 OUTLIER 'General case' 0 C--N 1.348 0.54 0 N-CA-C 102.614 -3.106 . . . . 0.0 102.614 -172.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.65 130.29 56.81 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 122.765 0.426 . . . . 0.0 110.255 -166.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . 0.637 ' SG ' ' HB2' ' A' ' 56' ' ' SER . 42.8 t -149.03 151.63 34.86 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.281 -179.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -80.49 -30.34 37.37 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.94 0.896 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -92.5 111.32 22.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.323 1.049 . . . . 0.0 109.12 -176.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -53.7 -35.22 60.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.59 1.156 . . . . 0.0 112.891 -175.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.01 -48.69 77.73 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 123.965 0.791 . . . . 0.0 111.634 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . 0.637 ' HB2' ' SG ' ' A' ' 51' ' ' CYS . 46.4 m -52.07 -50.96 60.51 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -173.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -72.18 -33.62 67.81 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 119.366 -0.35 . . . . 0.0 111.112 177.734 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -57.4 -38.38 74.2 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.853 0.861 . . . . 0.0 111.849 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 72.4 m95 -78.86 -27.42 44.11 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.549 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 16.3 t60 -77.25 -30.06 54.29 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.784 0.833 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.497 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 94.9 mtp -69.05 -38.69 79.26 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.849 0.46 . . . . 0.0 110.426 176.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -64.59 -28.48 69.66 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.175 176.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.549 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 28.9 mmmt -55.96 -36.54 67.93 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.544 0.338 . . . . 0.0 111.371 170.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.497 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 92.3 m-70 . . . . . 0 N--CA 1.495 1.825 0 C-N-CA 123.08 0.552 . . . . 0.0 111.539 176.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.4 p . . . . . 0 N--CA 1.466 0.329 0 N-CA-C 109.248 -0.649 . . . . 0.0 109.248 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.0 120.98 13.04 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.864 0.866 . . . . 0.0 109.417 172.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -57.39 -27.76 62.63 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.34 0.656 . . . . 0.0 112.077 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.1 mt -93.63 -39.35 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -172.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.5 p -135.1 -1.56 2.63 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.83 1.196 . . . . 0.0 113.095 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 58.27 34.19 73.2 Favored Glycine 0 C--N 1.364 2.096 0 N-CA-C 114.624 0.61 . . . . 0.0 114.624 172.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 81' ' ' PHE . 9.2 tmtt? -63.92 -39.57 94.48 Favored 'General case' 0 CA--C 1.56 1.349 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -173.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' LYS . 4.9 mptp? 80.55 119.74 0.05 Allowed 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 124.914 1.285 . . . . 0.0 110.534 -174.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 79.2 m-85 -133.13 149.06 52.12 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.623 1.169 . . . . 0.0 108.648 176.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -9.1 9.34 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -174.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HG3' ' H ' ' A' ' 86' ' ' SER . 24.2 pttm -151.52 147.17 26.5 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 173.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.42 -28.42 68.26 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.063 0.945 . . . . 0.0 110.689 176.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.69 -42.21 74.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.621 0.769 . . . . 0.0 111.462 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . 0.462 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 75.4 m -71.11 -29.05 64.78 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.202 0.314 . . . . 0.0 111.156 176.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.3 t -72.55 -44.97 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.834 0.854 . . . . 0.0 110.06 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 87.3 t -72.73 -39.46 60.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 C-N-CA 124.73 1.212 . . . . 0.0 109.447 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.35 -37.33 85.1 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.609 177.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -71.92 -32.2 67.13 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.723 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -71.95 -38.75 69.74 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 109.583 -178.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.56 -17.77 59.95 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.024 177.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -97.65 -45.65 6.3 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.459 0.704 . . . . 0.0 111.591 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 45.2 t -100.42 -14.93 18.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.712 1.205 . . . . 0.0 111.409 -168.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 . . . . . 0 CA--C 1.565 1.538 0 C-N-CA 123.826 0.85 . . . . 0.0 109.975 177.769 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 . . . . . 0 N--CA 1.48 1.066 0 CA-C-O 122.367 1.079 . . . . 0.0 108.132 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -120.75 80.99 1.7 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.423 -1.262 . . . . 0.0 107.89 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -78.84 118.38 20.82 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 113.393 -1.731 . . . . 0.0 109.501 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.2 mm -104.02 112.61 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.755 -171.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.5 t -59.99 101.43 0.12 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 161.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 31.48 -64.66 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 128.32 2.648 . . . . 0.0 115.592 160.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -125.04 -40.88 2.13 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.009 -166.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.16 -46.21 9.97 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.953 -163.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.82 127.16 31.42 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -68.74 -62.38 1.41 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.105 161.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.25 126.89 1.18 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.295 0.638 . . . . 0.0 110.833 164.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -98.71 144.72 27.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -71.88 -19.28 61.97 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -143.66 144.3 31.82 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.586 0.754 . . . . 0.0 110.055 -175.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' SER . . . . . 0.424 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.3 p -58.0 -32.98 68.44 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.853 0.861 . . . . 0.0 111.113 168.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' HIS . . . . . 0.457 ' O ' HG23 ' A' ' 31' ' ' VAL . 24.4 m-70 -68.03 -38.24 82.29 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.545 0.738 . . . . 0.0 109.994 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -49.45 75.24 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.136 0.974 . . . . 0.0 110.344 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.5 OUTLIER -60.69 -36.59 79.15 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.322 178.368 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.49 -30.88 71.93 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.534 1.146 . . . . 0.0 112.284 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 27' ' ' HIS . 48.3 t -66.45 -45.37 89.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.146 0.578 . . . . 0.0 110.443 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -33.66 68.47 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.524 0.729 . . . . 0.0 109.903 177.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' ARG . . . . . 0.532 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 57.6 ttt180 -63.05 -2.55 1.3 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.619 1.168 . . . . 0.0 112.226 -176.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.9 ptm -45.93 -11.6 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 126.241 1.817 . . . . 0.0 114.612 173.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -83.75 -60.96 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.581 2.159 0 C-N-CA 124.934 1.294 . . . . 0.0 109.673 168.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' HIS . . . . . 0.532 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.24 9.85 37.96 Favored 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -172.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -61.81 -56.59 17.8 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -167.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.19 -32.65 3.77 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 123.353 0.501 . . . . 0.0 112.388 -167.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -70.68 -46.56 62.96 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.706 0.802 . . . . 0.0 111.614 176.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt 70.7 94.96 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 125.26 1.424 . . . . 0.0 110.934 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.14 -177.4 2.3 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.512 2.141 . . . . 0.0 111.069 174.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -110.38 109.26 19.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.254 0.622 . . . . 0.0 109.534 -170.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.28 146.29 39.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.626 0.77 . . . . 0.0 109.248 -178.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 4.3 t -64.35 108.49 1.63 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.635 0.774 . . . . 0.0 110.177 171.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -67.37 4.78 0.9 Allowed 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 36.6 mm -95.23 -54.73 6.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.441 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' CYS . . . . . 0.538 ' HG ' ' H ' ' A' ' 48' ' ' GLY . 19.6 p -120.47 -110.94 0.34 Allowed 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . 0.538 ' H ' ' HG ' ' A' ' 47' ' ' CYS . . . -147.23 164.33 28.66 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 108.798 -1.721 . . . . 0.0 108.798 156.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.4 t80 171.24 110.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 102.449 -3.167 . . . . 0.0 102.449 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.65 132.44 56.68 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.79 0.805 . . . . 0.0 109.446 -164.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.1 t -152.54 166.19 32.79 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.317 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -100.37 -6.74 25.3 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.071 0.549 . . . . 0.0 110.37 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.608 HE21 ' HB3' ' A' ' 55' ' ' ALA . 51.9 tt0 -113.21 112.3 23.53 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.396 1.078 . . . . 0.0 109.249 -175.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -51.95 -38.01 54.97 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.691 0.797 . . . . 0.0 112.537 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ALA . . . . . 0.608 ' HB3' HE21 ' A' ' 53' ' ' GLN . . . -59.64 -39.06 83.08 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.979 0.799 . . . . 0.0 112.364 -178.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -59.28 -54.98 40.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.293 0.637 . . . . 0.0 111.395 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LEU . . . . . 0.504 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.6 OUTLIER -76.58 -29.5 56.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.057 0.543 . . . . 0.0 112.183 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.82 -37.18 63.31 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.583 0.753 . . . . 0.0 112.781 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' TRP . . . . . 0.445 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 95.7 m95 -80.55 -47.34 14.34 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 72.7 t60 -45.45 -42.49 10.55 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' MET . . . . . 0.5 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 26.0 ptm -67.2 -38.74 85.85 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 118.524 0.602 . . . . 0.0 112.4 174.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -63.33 -30.47 71.6 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.309 0.644 . . . . 0.0 111.3 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.445 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 95.4 mttt -66.6 -28.6 68.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.258 0.623 . . . . 0.0 111.253 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' HIS . . . . . 0.5 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 76.6 m-70 . . . . . 0 N--CA 1.486 1.349 0 C-N-CA 123.395 0.678 . . . . 0.0 111.166 174.824 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 CA--C 1.519 -0.212 0 CA-C-O 121.327 0.584 . . . . 0.0 110.281 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.5 t -97.71 116.26 29.59 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 167.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -64.96 -19.54 66.02 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.307 0.503 . . . . 0.0 111.763 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.62 -40.03 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.233 0.613 . . . . 0.0 111.683 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -141.08 -0.88 1.42 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.54 40.65 98.08 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 114.444 0.538 . . . . 0.0 114.444 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 5.9 tmtt? -66.36 -28.98 69.07 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 123.401 0.68 . . . . 0.0 112.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt 71.42 110.53 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 125.316 1.446 . . . . 0.0 111.037 172.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' PHE . . . . . 0.415 ' CE2' ' HB3' ' A' ' 79' ' ' LYS . 97.1 m-85 -120.38 164.64 16.05 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -172.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -67.99 -35.55 78.53 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 114.649 -1.159 . . . . 0.0 113.027 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.87 170.54 19.57 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 117.93 0.332 . . . . 0.0 111.633 175.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -57.47 -40.0 77.6 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.839 1.255 . . . . 0.0 110.913 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.35 -44.47 72.19 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 123.571 0.545 . . . . 0.0 111.228 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.5 m -63.78 -34.84 78.81 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.513 0.508 . . . . 0.0 111.742 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.79 -41.49 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.424 0.69 . . . . 0.0 110.251 -175.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 89.1 t -72.42 -38.6 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.877 1.271 . . . . 0.0 109.038 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.2 96.67 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.139 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -71.9 -31.56 66.53 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.952 -178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.88 -45.23 62.04 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.21 -33.19 74.09 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.013 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -92.38 -47.63 7.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.533 0.733 . . . . 0.0 111.528 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.94 -7.46 21.47 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.616 0.766 . . . . 0.0 111.918 -168.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 . . . . . 0 CA--C 1.567 1.632 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 177.609 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.6 m80 . . . . . 0 N--CA 1.474 0.773 0 N-CA-C 110.17 -0.308 . . . . 0.0 110.17 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 74.7 mtm -138.67 -55.16 0.62 Allowed 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 123.959 0.904 . . . . 0.0 109.131 171.758 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.9 mpt_? -102.31 30.8 4.34 Favored 'General case' 0 N--CA 1.484 1.231 0 CA-C-O 121.791 0.805 . . . . 0.0 109.429 176.234 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.5 m-20 -121.09 81.24 1.75 Allowed 'General case' 0 C--O 1.238 0.461 0 CA-C-N 114.7 -1.137 . . . . 0.0 108.521 -173.021 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 81.5 m-85 -78.64 110.23 13.57 Favored 'General case' 0 C--N 1.317 -0.834 0 CA-C-N 114.03 -1.441 . . . . 0.0 109.962 -174.457 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 30.7 mm -109.19 131.78 59.06 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 C-N-CA 123.774 0.83 . . . . 0.0 109.179 -175.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.817 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 36.2 t -90.13 52.81 2.34 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 124.394 1.077 . . . . 0.0 109.025 179.016 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.7 mp0 56.76 -53.12 0.03 OUTLIER 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 126.988 2.115 . . . . 0.0 115.48 -173.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.3 m-85 -134.44 -45.23 0.76 Allowed 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.017 1.327 . . . . 0.0 109.817 -166.692 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.5 p -107.2 37.39 2.39 Favored 'General case' 0 CA--C 1.541 0.617 0 CA-C-N 114.639 -1.164 . . . . 0.0 111.529 -167.899 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.817 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -142.68 122.93 13.82 Favored 'General case' 0 N--CA 1.468 0.44 0 C-N-CA 123.193 0.597 . . . . 0.0 109.416 160.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -67.13 -55.65 13.3 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.413 1.071 . . . . 0.0 109.996 176.7 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.55 130.06 0.55 Allowed 'General case' 0 C--N 1.355 0.831 0 C-N-CA 124.036 0.934 . . . . 0.0 109.621 161.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 86.4 m-85 -110.48 154.9 23.0 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 170.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -100.0 5.58 45.12 Favored 'General case' 0 N--CA 1.478 0.971 0 N-CA-C 112.359 0.503 . . . . 0.0 112.359 -179.055 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 28.3 t -152.14 139.92 19.91 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 123.311 0.645 . . . . 0.0 109.55 178.315 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.479 ' HA ' HD23 ' A' ' 29' ' ' LEU . 32.3 t -52.56 -38.9 60.8 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.599 1.16 . . . . 0.0 111.958 175.313 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.496 ' O ' HG23 ' A' ' 31' ' ' VAL . 29.6 t-80 -69.84 -39.22 76.56 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.67 0.388 . . . . 0.0 111.345 179.132 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 7.2 m-20 -56.86 -47.84 79.46 Favored 'General case' 0 N--CA 1.494 1.746 0 CA-C-O 121.592 0.71 . . . . 0.0 110.911 179.127 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.696 HD11 HH11 ' A' ' 33' ' ' ARG . 0.2 OUTLIER -63.99 -37.98 89.4 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 114.845 -1.07 . . . . 0.0 110.582 175.376 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.42 -27.86 68.84 Favored 'General case' 0 CA--C 1.55 0.953 0 C-N-CA 123.866 0.866 . . . . 0.0 112.162 179.119 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.605 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 70.9 t -61.11 -45.2 99.04 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.179 0 C-N-CA 124.039 0.935 . . . . 0.0 110.666 174.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.5 t60 -70.26 -36.65 74.59 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 122.967 0.507 . . . . 0.0 110.438 173.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.696 HH11 HD11 ' A' ' 29' ' ' LEU . 13.4 ttt180 -68.76 6.82 0.77 Allowed 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 124.308 1.043 . . . . 0.0 112.608 -170.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.1 ptm -45.91 -15.67 0.03 OUTLIER 'General case' 0 N--CA 1.506 2.33 0 C-N-CA 125.901 1.681 . . . . 0.0 114.743 173.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.08 -54.32 8.83 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.309 0 C-N-CA 124.941 1.297 . . . . 0.0 109.05 177.46 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.549 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -107.3 2.03 24.25 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 115.364 1.616 . . . . 0.0 115.364 -173.666 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.48 HG23 ' H ' ' A' ' 39' ' ' GLU . 13.0 t -82.29 -41.43 20.16 Favored 'General case' 0 N--CA 1.5 2.056 0 CA-C-N 120.058 1.299 . . . . 0.0 113.81 -165.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 105.04 -31.26 8.76 Favored Glycine 0 CA--C 1.531 1.084 0 N-CA-C 114.155 0.422 . . . . 0.0 114.155 -175.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.48 ' H ' HG23 ' A' ' 37' ' ' THR . 2.2 mp0 -84.37 -51.26 7.1 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 117.231 0.516 . . . . 0.0 110.226 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 94.8 mttt 67.17 99.8 0.04 OUTLIER Pre-proline 0 CA--C 1.553 1.071 0 C-N-CA 125.693 1.597 . . . . 0.0 111.546 178.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.605 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 73.9 Cg_endo -69.87 -147.76 0.02 OUTLIER 'Trans proline' 0 C--N 1.379 2.162 0 C-N-CA 122.985 2.457 . . . . 0.0 111.905 170.582 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.0 mt -129.32 116.95 19.86 Favored 'General case' 0 N--CA 1.482 1.125 0 O-C-N 121.739 -0.6 . . . . 0.0 111.726 -174.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 45.7 tt0 -108.98 142.74 39.2 Favored 'General case' 0 N--CA 1.471 0.605 0 C-N-CA 123.953 0.901 . . . . 0.0 109.334 175.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.482 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 13.5 t -64.49 112.18 3.02 Favored 'General case' 0 C--O 1.24 0.568 0 C-N-CA 124.702 1.201 . . . . 0.0 109.689 170.058 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 7.5 tp10 -79.52 29.31 0.24 Allowed 'General case' 0 N--CA 1.487 1.425 0 C-N-CA 125.0 1.32 . . . . 0.0 111.77 -174.093 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.482 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 2.8 mp -119.95 -16.0 7.38 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 124.494 1.118 . . . . 0.0 108.759 -173.808 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.552 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 1.4 p -175.97 -134.29 0.01 OUTLIER 'General case' 0 C--O 1.245 0.852 0 N-CA-C 103.322 -2.844 . . . . 0.0 103.322 -156.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.552 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.94 131.48 4.14 Favored Glycine 0 C--N 1.309 -0.95 0 N-CA-C 109.085 -1.606 . . . . 0.0 109.085 169.76 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 39.5 t80 176.9 113.37 0.03 OUTLIER 'General case' 0 C--N 1.349 0.573 0 N-CA-C 101.954 -3.35 . . . . 0.0 101.954 -175.248 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.0 m -128.73 139.99 51.95 Favored 'General case' 0 C--O 1.242 0.71 0 N-CA-C 108.917 -0.771 . . . . 0.0 108.917 -166.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.533 ' SG ' ' HB3' ' A' ' 57' ' ' LEU . 19.3 p -153.78 166.06 34.06 Favored 'General case' 0 C--O 1.241 0.613 0 CA-C-N 115.229 -0.896 . . . . 0.0 111.166 -174.346 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 9.9 ptm180 -88.88 -31.07 18.43 Favored 'General case' 0 CA--C 1.545 0.76 0 CA-C-N 114.962 -1.017 . . . . 0.0 111.264 -175.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.01 138.0 38.63 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 123.699 0.8 . . . . 0.0 109.121 -175.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.69 -36.05 82.59 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.323 0.86 . . . . 0.0 113.323 -174.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -64.63 -43.22 94.39 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 113.097 0.777 . . . . 0.0 113.097 -179.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 3.4 p -55.49 -47.91 75.42 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 113.415 0.895 . . . . 0.0 113.415 -173.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.533 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 2.0 pt? -76.41 -37.44 57.07 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-N 118.487 0.585 . . . . 0.0 111.044 173.922 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.1 t30 -52.8 -44.61 66.74 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 123.808 0.843 . . . . 0.0 113.034 -176.622 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.419 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 100.0 m95 -80.9 -36.92 30.55 Favored 'General case' 0 N--CA 1.465 0.281 0 CA-C-N 115.891 -0.595 . . . . 0.0 109.74 -177.231 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.404 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 58.5 t60 -53.84 -33.33 55.93 Favored 'General case' 0 CA--C 1.568 1.658 0 N-CA-C 113.172 0.805 . . . . 0.0 113.172 165.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.44 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 68.2 mtm -72.82 -37.86 67.35 Favored 'General case' 0 N--CA 1.49 1.539 0 CA-C-N 118.449 0.568 . . . . 0.0 110.425 174.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 2.2 tpmt? -59.01 -34.16 71.55 Favored 'General case' 0 CA--C 1.559 1.299 0 C-N-CA 123.808 0.843 . . . . 0.0 111.281 171.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.489 ' HA ' ' HB2' ' A' ' 68' ' ' SER . 33.8 mmtp -56.87 -28.78 62.22 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-N 115.047 -0.979 . . . . 0.0 112.641 172.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.1 m-70 -89.6 -24.3 21.73 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 122.67 0.388 . . . . 0.0 110.745 179.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.418 ' HA ' ' HB2' ' A' ' 75' ' ' ASN . 20.8 t70 -53.08 -64.63 0.76 Allowed 'General case' 0 N--CA 1.49 1.53 0 O-C-N 124.462 1.101 . . . . 0.0 111.647 -162.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.581 ' HA ' HG11 ' A' ' 87' ' ' VAL . . . -110.79 16.08 21.54 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 114.471 -1.241 . . . . 0.0 109.422 172.712 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.495 ' HB2' ' HB2' ' A' ' 73' ' ' SER . 30.2 t0 57.76 71.68 0.56 Allowed 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.935 1.694 . . . . 0.0 112.551 -173.644 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.489 ' HB2' ' HA ' ' A' ' 63' ' ' LYS . 75.7 m -80.64 -9.15 59.8 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.154 -1.385 . . . . 0.0 110.985 166.49 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -74.35 -40.54 62.07 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.907 0.883 . . . . 0.0 109.418 -178.781 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 88.6 m-85 -125.54 -96.98 0.43 Allowed 'General case' 0 CA--C 1.548 0.899 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 46.2 mt-30 -118.23 -82.67 0.64 Allowed 'General case' 0 C--N 1.357 0.928 0 C-N-CA 123.357 0.663 . . . . 0.0 110.643 -173.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 63.2 m-85 -155.06 129.04 8.76 Favored 'General case' 0 C--N 1.363 1.172 0 N-CA-C 106.796 -1.557 . . . . 0.0 106.796 -177.618 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.495 ' HB2' ' HB2' ' A' ' 67' ' ' ASP . 20.0 m -159.51 165.46 32.95 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 125.492 1.517 . . . . 0.0 108.423 177.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -95.3 124.64 39.44 Favored 'General case' 0 C--N 1.327 -0.372 0 N-CA-C 107.967 -1.123 . . . . 0.0 107.967 167.065 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.418 ' HB2' ' HA ' ' A' ' 65' ' ' ASP . 41.2 t30 -54.11 -39.29 66.26 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-O 121.296 0.569 . . . . 0.0 111.692 176.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.0 mt -86.12 -47.49 16.42 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.711 0 CA-C-N 115.463 -0.789 . . . . 0.0 111.5 -166.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 20.3 p -126.99 3.42 6.53 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 119.319 0.963 . . . . 0.0 112.697 -175.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 52.61 37.87 51.21 Favored Glycine 0 C--N 1.361 1.972 0 N-CA-C 114.783 0.673 . . . . 0.0 114.783 174.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.76 -30.29 71.4 Favored 'General case' 0 CA--C 1.55 0.97 0 C-N-CA 122.83 0.452 . . . . 0.0 111.276 -176.102 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.7 mmmt 75.11 122.34 0.04 OUTLIER 'General case' 0 C--N 1.36 1.045 0 C-N-CA 125.04 1.336 . . . . 0.0 109.587 179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 98.0 m-85 -130.86 162.91 28.58 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.551 0.741 . . . . 0.0 111.717 -177.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -62.75 -44.46 96.13 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.399 1.08 . . . . 0.0 111.855 177.04 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.469 ' HG3' ' HB2' ' A' ' 85' ' ' ASP . 5.5 ptmm? -140.99 156.33 46.06 Favored 'General case' 0 C--O 1.237 0.447 0 C-N-CA 123.353 0.661 . . . . 0.0 109.729 -173.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -60.85 -31.56 70.99 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.894 0.878 . . . . 0.0 111.328 -179.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.469 ' HB2' ' HG3' ' A' ' 83' ' ' LYS . 8.3 m-20 -56.32 -43.05 78.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.528 0.731 . . . . 0.0 111.688 174.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 44.4 m -64.54 -31.56 72.82 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.033 0.533 . . . . 0.0 111.389 177.041 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.581 HG11 ' HA ' ' A' ' 66' ' ' ALA . 41.8 t -75.66 -46.14 37.09 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 CA-C-O 121.153 0.501 . . . . 0.0 110.479 -176.517 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 75.9 t -70.92 -38.04 70.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.88 0 CA-C-N 114.377 -1.283 . . . . 0.0 109.15 -174.173 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.19 -40.88 90.76 Favored 'General case' 0 C--N 1.349 0.551 0 CA-C-N 114.756 -1.111 . . . . 0.0 109.582 175.815 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -70.26 -37.61 74.95 Favored 'General case' 0 N--CA 1.476 0.866 0 CA-C-N 115.357 -0.838 . . . . 0.0 111.881 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 44.8 tttm -72.81 -38.45 67.18 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 123.456 0.702 . . . . 0.0 109.787 -173.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.83 -23.08 65.99 Favored 'General case' 0 CA--C 1.548 0.872 0 CA-C-N 115.078 -0.965 . . . . 0.0 111.983 177.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.4 mttt -102.75 -49.29 3.85 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 112.212 0.449 . . . . 0.0 112.212 -176.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 22.6 t -88.48 -6.93 57.32 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 124.229 1.011 . . . . 0.0 111.607 -170.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -137.3 67.05 53.59 Favored Pre-proline 0 N--CA 1.478 0.952 0 C-N-CA 122.797 0.439 . . . . 0.0 110.2 179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.6 Cg_endo -71.37 -37.33 5.82 Favored 'Trans proline' 0 C--N 1.378 2.1 0 C-N-CA 121.935 1.756 . . . . 0.0 110.665 169.087 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -131.35 99.89 4.99 Favored 'General case' 0 C--N 1.348 0.512 0 N-CA-C 106.85 -1.537 . . . . 0.0 106.85 174.743 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 CA--C 1.567 1.626 0 C-N-CA 124.257 1.023 . . . . 0.0 111.918 177.815 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.411 ' HB3' ' O ' ' A' ' 13' ' ' ASP . 91.4 m-70 . . . . . 0 N--CA 1.475 0.809 0 N-CA-C 108.235 -1.024 . . . . 0.0 108.235 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.48 ' N ' ' SD ' ' A' ' 11' ' ' MET . 1.0 OUTLIER -93.85 -39.65 10.59 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.464 1.106 . . . . 0.0 109.799 -177.888 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 17.5 ptp180 -108.37 23.67 14.16 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 124.439 1.095 . . . . 0.0 110.514 177.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.411 ' O ' ' HB3' ' A' ' 10' ' ' HIS . 14.3 m-20 -144.64 100.21 3.48 Favored 'General case' 0 CA--C 1.519 -0.249 0 N-CA-C 107.471 -1.307 . . . . 0.0 107.471 -172.876 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 61.3 m-85 -86.64 104.48 16.1 Favored 'General case' 0 C--N 1.321 -0.631 0 N-CA-C 108.74 -0.837 . . . . 0.0 108.74 179.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.443 HG23 ' HB3' ' A' ' 20' ' ' ALA . 29.4 mm -111.12 133.12 57.7 Favored 'Isoleucine or valine' 0 C--O 1.234 0.273 0 N-CA-C 108.5 -0.926 . . . . 0.0 108.5 -173.739 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.464 ' HA ' HD13 ' A' ' 29' ' ' LEU . 41.8 t -54.96 -53.0 61.28 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 123.853 0.861 . . . . 0.0 110.865 174.997 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 172.15 -53.75 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.972 1.309 . . . . 0.0 108.711 177.377 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 16.6 t80 -140.59 -45.69 0.41 Allowed 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 107.819 -1.178 . . . . 0.0 107.819 -175.361 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.9 p -88.03 64.64 7.88 Favored 'General case' 0 CA--C 1.538 0.508 0 CA-C-N 113.581 -1.645 . . . . 0.0 109.703 178.66 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.443 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -157.7 134.0 9.59 Favored 'General case' 0 N--CA 1.467 0.421 0 CA-C-N 114.4 -1.273 . . . . 0.0 111.063 166.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -68.65 -81.16 0.04 OUTLIER 'General case' 0 CA--C 1.55 0.96 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 166.363 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -166.41 124.86 1.46 Allowed 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 123.653 0.781 . . . . 0.0 108.986 165.085 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.438 ' HB3' ' HB3' ' A' ' 28' ' ' ASN . 96.7 m-85 -102.34 150.59 23.18 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 123.64 0.776 . . . . 0.0 109.414 179.175 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -76.19 -17.24 59.63 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.847 0.459 . . . . 0.0 112.167 179.603 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 33.1 t -146.88 150.36 35.07 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 123.054 0.541 . . . . 0.0 110.701 -174.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.413 ' O ' ' HG ' ' A' ' 29' ' ' LEU . 66.5 p -58.73 -34.21 71.09 Favored 'General case' 0 CA--C 1.546 0.816 0 CA-C-N 114.8 -1.091 . . . . 0.0 111.408 170.128 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 66.6 m-70 -74.02 -35.49 64.38 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 123.763 0.825 . . . . 0.0 110.955 177.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.438 ' HB3' ' HB3' ' A' ' 23' ' ' PHE . 0.3 OUTLIER -60.62 -48.41 81.89 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.623 0.769 . . . . 0.0 109.906 174.734 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.464 HD13 ' HA ' ' A' ' 16' ' ' CYS . 0.5 OUTLIER -66.6 -35.07 79.3 Favored 'General case' 0 N--CA 1.48 1.043 0 CA-C-N 115.78 -0.646 . . . . 0.0 110.619 177.136 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.74 -31.14 68.04 Favored 'General case' 0 N--CA 1.487 1.409 0 O-C-N 124.29 0.994 . . . . 0.0 111.88 178.711 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 26.3 t -56.62 -49.99 75.55 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 C-N-CA 124.199 1.0 . . . . 0.0 111.411 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.5 OUTLIER -73.3 -34.9 65.99 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-O 121.398 0.618 . . . . 0.0 109.559 178.233 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.514 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 63.6 ttt180 -63.73 -7.76 8.55 Favored 'General case' 0 C--O 1.215 -0.762 0 CA-C-N 114.579 -1.191 . . . . 0.0 111.682 -175.442 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.3 ptm -43.97 -15.19 0.02 OUTLIER 'General case' 0 N--CA 1.507 2.386 0 N-CA-C 115.591 1.7 . . . . 0.0 115.591 179.428 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.25 -50.42 14.66 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.675 0 C-N-CA 124.559 1.143 . . . . 0.0 109.762 175.872 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.61 10.58 38.65 Favored 'General case' 0 N--CA 1.501 2.078 0 C-N-CA 125.009 1.323 . . . . 0.0 112.36 -177.919 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.514 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 9.0 t -55.91 -67.41 0.29 Allowed 'General case' 0 N--CA 1.488 1.431 0 N-CA-C 115.961 1.837 . . . . 0.0 115.961 -155.104 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . 0.432 ' H ' HG23 ' A' ' 37' ' ' THR . . . 69.81 36.56 74.63 Favored Glycine 0 N--CA 1.473 1.147 0 CA-C-N 118.644 0.656 . . . . 0.0 112.383 -176.712 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 16.4 pt-20 -169.74 -30.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 125.302 1.441 . . . . 0.0 108.181 -175.256 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 45.2 mtmt 66.53 97.92 0.04 OUTLIER Pre-proline 0 CA--C 1.548 0.874 0 C-N-CA 125.166 1.386 . . . . 0.0 113.555 164.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.51 164.33 26.22 Favored 'Trans proline' 0 C--N 1.366 1.475 0 C-N-CA 122.099 1.866 . . . . 0.0 110.046 160.645 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 80.9 mt -103.93 121.32 42.88 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 123.574 0.75 . . . . 0.0 109.17 -177.173 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -109.57 143.53 39.14 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 -174.222 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.421 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 14.5 t -69.57 109.68 4.42 Favored 'General case' 0 C--O 1.238 0.473 0 C-N-CA 123.725 0.81 . . . . 0.0 109.375 176.633 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -88.25 40.63 0.96 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.779 0.832 . . . . 0.0 110.428 -178.012 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.421 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.7 mp -130.97 -12.78 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.561 1.371 0 C-N-CA 124.945 1.298 . . . . 0.0 108.356 -179.254 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 4.8 p -175.57 -124.33 0.0 OUTLIER 'General case' 0 C--N 1.354 0.799 0 N-CA-C 102.693 -3.077 . . . . 0.0 102.693 -167.213 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.95 134.69 4.95 Favored Glycine 0 CA--C 1.527 0.829 0 CA-C-O 117.251 -1.86 . . . . 0.0 108.638 163.733 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 22.8 t80 177.57 115.95 0.03 OUTLIER 'General case' 0 C--N 1.356 0.886 0 N-CA-C 102.538 -3.134 . . . . 0.0 102.538 -176.441 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 2.6 m -110.48 146.19 36.38 Favored 'General case' 0 C--N 1.325 -0.499 0 CA-C-O 121.504 0.669 . . . . 0.0 109.724 -171.027 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.565 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 43.6 t -144.83 -170.95 3.52 Favored 'General case' 0 C--N 1.311 -1.1 0 C-N-CA 125.675 1.59 . . . . 0.0 107.886 177.6 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' N ' ' SG ' ' A' ' 51' ' ' CYS . 14.5 ptm180 -131.94 -19.96 2.54 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 123.694 0.798 . . . . 0.0 110.717 175.219 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.635 HE22 ' HB3' ' A' ' 55' ' ' ALA . 0.5 OUTLIER -102.26 125.06 48.85 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 124.173 0.989 . . . . 0.0 108.353 -179.329 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.0 mtpp -52.9 -56.08 18.57 Favored 'General case' 0 N--CA 1.491 1.604 0 C-N-CA 124.472 1.109 . . . . 0.0 113.266 -172.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.635 ' HB3' HE22 ' A' ' 53' ' ' GLN . . . -53.71 -39.66 65.4 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.048 0.539 . . . . 0.0 112.193 -179.651 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.565 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 23.5 t -54.75 -55.74 26.71 Favored 'General case' 0 CA--C 1.561 1.382 0 N-CA-C 113.615 0.969 . . . . 0.0 113.615 -176.262 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.557 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.0 pt? -74.07 -26.31 60.32 Favored 'General case' 0 N--CA 1.487 1.411 0 CA-C-N 118.042 0.383 . . . . 0.0 110.866 176.509 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.48 ' O ' ' HG2' ' A' ' 61' ' ' MET . 6.0 t30 -62.88 -25.11 68.14 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.609 0.764 . . . . 0.0 112.126 169.747 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.2 m95 -82.62 -39.1 22.63 Favored 'General case' 0 N--CA 1.476 0.865 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 175.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.62 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 63.1 t60 -58.33 -31.12 67.25 Favored 'General case' 0 CA--C 1.563 1.451 0 N-CA-C 113.902 1.075 . . . . 0.0 113.902 169.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.48 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 26.2 ptm -71.7 -31.44 66.75 Favored 'General case' 0 N--CA 1.494 1.758 0 CA-C-N 119.496 1.044 . . . . 0.0 110.329 173.645 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -61.29 -32.67 72.52 Favored 'General case' 0 CA--C 1.556 1.198 0 C-N-CA 123.126 0.571 . . . . 0.0 111.311 170.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.62 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 27.5 mmmt -62.66 -35.86 81.0 Favored 'General case' 0 CA--C 1.56 1.347 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.832 170.584 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 94.5 m-70 -71.85 -25.6 62.03 Favored 'General case' 0 N--CA 1.494 1.729 0 C-N-CA 123.244 0.617 . . . . 0.0 111.584 170.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.5 t70 -82.98 -15.12 52.49 Favored 'General case' 0 N--CA 1.485 1.311 0 N-CA-C 108.806 -0.813 . . . . 0.0 108.806 -177.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -67.9 -57.14 6.73 Favored 'General case' 0 C--O 1.238 0.478 0 CA-C-N 115.516 -0.766 . . . . 0.0 109.42 170.242 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 8.9 t70 75.99 -36.01 0.27 Allowed 'General case' 0 N--CA 1.495 1.82 0 C-N-CA 125.385 1.474 . . . . 0.0 112.849 174.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 34.0 t -62.78 -13.74 36.84 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 125.086 1.354 . . . . 0.0 113.55 -176.496 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 56.1 m-85 -57.57 -45.84 84.72 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.047 0.539 . . . . 0.0 111.158 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 62.1 m-85 40.94 69.75 0.31 Allowed 'General case' 0 N--CA 1.474 0.755 0 O-C-N 124.896 1.372 . . . . 0.0 110.88 -169.803 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -59.13 -36.12 74.66 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.902 -1.044 . . . . 0.0 111.935 -166.839 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 42.2 m-85 -120.05 160.34 23.0 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 124.45 1.1 . . . . 0.0 109.675 176.525 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.596 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 13.3 p -145.14 165.39 28.44 Favored 'General case' 0 C--N 1.323 -0.57 0 C-N-CA 125.079 1.352 . . . . 0.0 109.498 178.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 12.8 t -109.55 115.35 29.74 Favored 'General case' 0 C--N 1.329 -0.295 0 N-CA-C 106.513 -1.662 . . . . 0.0 106.513 175.944 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -67.75 -14.64 63.12 Favored 'General case' 0 CA--C 1.555 1.135 0 N-CA-C 111.976 0.361 . . . . 0.0 111.976 -175.87 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.492 HD11 ' HE3' ' A' ' 91' ' ' LYS . 2.6 mt -90.06 -38.6 11.21 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.089 0 C-N-CA 123.423 0.689 . . . . 0.0 112.078 -174.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -137.76 -1.72 2.0 Allowed 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 113.207 0.818 . . . . 0.0 113.207 -179.031 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 66.59 38.78 93.58 Favored Glycine 0 C--N 1.349 1.289 0 N-CA-C 113.895 0.318 . . . . 0.0 113.895 173.194 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.76 -40.47 92.07 Favored 'General case' 0 CA--C 1.562 1.407 0 C-N-CA 122.923 0.489 . . . . 0.0 111.672 -178.251 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.596 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 14.0 mptt 72.54 116.81 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 124.947 1.299 . . . . 0.0 111.034 -177.327 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -125.1 163.67 21.89 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.854 0.862 . . . . 0.0 111.176 -178.164 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -73.66 -44.85 55.67 Favored 'General case' 0 CA--C 1.542 0.67 0 C-N-CA 123.741 0.816 . . . . 0.0 112.419 176.329 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 21.2 pttm -145.7 163.4 35.02 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.727 0.411 . . . . 0.0 111.793 -167.635 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -49.67 -39.35 36.21 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 125.488 1.515 . . . . 0.0 112.062 178.527 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -52.91 -46.25 67.93 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 124.458 1.099 . . . . 0.0 111.154 -178.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.5 m -71.98 -35.75 69.6 Favored 'General case' 0 CA--C 1.556 1.197 0 CA-C-N 115.316 -0.856 . . . . 0.0 112.517 -178.773 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -75.28 -51.04 22.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 C-N-CA 123.963 0.905 . . . . 0.0 111.345 -170.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 67.5 t -72.01 -34.38 50.4 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 CA-C-N 114.353 -1.294 . . . . 0.0 109.257 -172.396 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.74 -44.92 88.57 Favored 'General case' 0 C--N 1.351 0.661 0 CA-C-N 114.61 -1.177 . . . . 0.0 109.304 175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 17.0 t60 -72.18 -33.7 67.88 Favored 'General case' 0 N--CA 1.48 1.028 0 CA-C-N 115.197 -0.91 . . . . 0.0 111.998 -175.828 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.492 ' HE3' HD11 ' A' ' 76' ' ' ILE . 87.2 tttt -73.12 -44.36 60.37 Favored 'General case' 0 N--CA 1.476 0.864 0 CA-C-O 121.322 0.582 . . . . 0.0 110.171 -178.622 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.76 -22.54 67.01 Favored 'General case' 0 CA--C 1.547 0.83 0 CA-C-N 114.768 -1.105 . . . . 0.0 112.174 -179.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -106.35 -50.19 3.2 Favored 'General case' 0 N--CA 1.483 1.184 0 N-CA-C 111.921 0.341 . . . . 0.0 111.921 -176.303 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 34.1 t -90.66 -9.3 47.38 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.52 0.728 . . . . 0.0 111.49 -168.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 66.8 m-70 -139.08 62.74 27.38 Favored Pre-proline 0 N--CA 1.484 1.266 0 C-N-CA 123.295 0.638 . . . . 0.0 110.634 178.881 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -66.43 -25.57 48.49 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.577 2.185 . . . . 0.0 111.634 174.96 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -123.77 95.47 4.58 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 124.67 1.188 . . . . 0.0 108.026 173.615 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.2 p . . . . . 0 CA--C 1.558 1.257 0 CA-C-N 114.913 -1.04 . . . . 0.0 110.583 178.326 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.4 m80 . . . . . 0 N--CA 1.486 1.334 0 CA-C-O 120.777 0.322 . . . . 0.0 110.479 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 8.7 mmt -128.19 -54.03 1.28 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 125.315 1.446 . . . . 0.0 108.907 175.104 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.4 mtt180 -126.72 55.4 1.54 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 107.051 -1.463 . . . . 0.0 107.051 176.092 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.5 m-20 -129.25 83.27 2.13 Favored 'General case' 0 C--N 1.346 0.442 0 N-CA-C 107.947 -1.131 . . . . 0.0 107.947 -170.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 63.5 m-85 -97.8 120.89 39.0 Favored 'General case' 0 C--N 1.325 -0.495 0 CA-C-N 114.254 -1.339 . . . . 0.0 108.573 -178.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.686 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -118.42 157.87 19.72 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.067 0.947 . . . . 0.0 109.147 -164.825 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.688 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.9 t -96.74 -12.37 23.82 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.186 0.594 . . . . 0.0 110.744 176.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.686 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.5 tt0 97.59 -20.53 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.565 0 C-N-CA 126.513 1.925 . . . . 0.0 111.065 167.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.7 t80 -135.9 -51.5 0.73 Allowed 'General case' 0 N--CA 1.476 0.841 0 CA-C-O 121.871 0.843 . . . . 0.0 109.138 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.9 p -121.17 72.67 1.0 Allowed 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.768 -1.105 . . . . 0.0 110.464 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.688 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.03 145.74 4.32 Favored 'General case' 0 N--CA 1.473 0.68 0 CA-C-O 121.966 0.889 . . . . 0.0 112.694 163.09 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.8 ptm180 -77.13 -168.23 1.05 Allowed 'General case' 0 CA--C 1.551 1.005 0 CA-C-N 113.318 -1.764 . . . . 0.0 109.377 162.577 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -80.75 125.44 30.06 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.19 0.596 . . . . 0.0 109.823 175.19 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.588 ' HE1' ' HB1' ' A' ' 20' ' ' ALA . 77.1 m-85 -111.53 148.88 32.26 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.742 0.817 . . . . 0.0 109.044 174.634 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.8 ptpt -61.98 -30.17 70.76 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.091 0.556 . . . . 0.0 111.669 -179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 53.1 m -144.85 151.06 38.18 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 123.32 0.648 . . . . 0.0 110.83 -173.729 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.534 ' HA ' HD23 ' A' ' 29' ' ' LEU . 34.4 t -57.55 -37.11 72.56 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.871 0.868 . . . . 0.0 111.462 172.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 26.0 m-70 -69.54 -35.25 75.27 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.028 0.931 . . . . 0.0 111.98 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -61.92 -45.88 91.77 Favored 'General case' 0 N--CA 1.485 1.282 0 CA-C-O 121.462 0.648 . . . . 0.0 110.643 174.681 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.534 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -68.36 -29.54 68.28 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.221 -0.899 . . . . 0.0 110.676 174.274 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -62.75 -26.31 68.63 Favored 'General case' 0 N--CA 1.485 1.322 0 C-N-CA 123.349 0.66 . . . . 0.0 111.568 176.181 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 64.1 t -61.84 -47.64 92.33 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.239 0 C-N-CA 122.845 0.458 . . . . 0.0 110.241 171.426 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 11.3 t60 -62.32 -38.4 89.29 Favored 'General case' 0 N--CA 1.495 1.821 0 C-N-CA 123.732 0.813 . . . . 0.0 110.407 172.802 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 54.6 ttt180 -65.29 2.37 0.86 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.733 1.213 . . . . 0.0 112.214 -175.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.1 ptp -44.81 -19.48 0.03 OUTLIER 'General case' 0 N--CA 1.501 2.104 0 C-N-CA 125.209 1.404 . . . . 0.0 113.425 171.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.9 tp -86.52 -51.02 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 125.538 1.535 . . . . 0.0 110.572 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.4 OUTLIER -101.87 5.33 40.93 Favored 'General case' 0 N--CA 1.513 2.704 0 C-N-CA 123.451 0.7 . . . . 0.0 112.235 -173.465 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 3.7 t -59.32 -57.33 13.47 Favored 'General case' 0 N--CA 1.484 1.228 0 N-CA-C 113.695 0.998 . . . . 0.0 113.695 -164.084 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 79.67 -31.66 2.18 Favored Glycine 0 CA--C 1.538 1.53 0 N-CA-C 112.414 -0.274 . . . . 0.0 112.414 -169.191 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -72.43 -45.82 57.87 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.41 1.484 . . . . 0.0 109.91 175.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 69.7 mmtt 66.42 98.3 0.04 OUTLIER Pre-proline 0 C--N 1.357 0.932 0 O-C-N 124.918 1.386 . . . . 0.0 111.072 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 10.4 Cg_exo -70.68 -170.89 0.49 Allowed 'Trans proline' 0 C--N 1.382 2.339 0 C-N-CA 122.899 2.399 . . . . 0.0 111.391 175.023 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.486 HD13 ' HB3' ' A' ' 54' ' ' LYS . 39.8 mt -99.02 119.37 37.67 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 108.354 -0.98 . . . . 0.0 108.354 -172.013 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.414 ' HG3' ' H ' ' A' ' 49' ' ' PHE . 50.7 tt0 -135.45 144.38 46.43 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 122.716 0.407 . . . . 0.0 111.542 -171.841 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.45 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 6.6 t -64.93 107.7 1.56 Allowed 'General case' 0 N--CA 1.47 0.531 0 C-N-CA 124.174 0.989 . . . . 0.0 110.684 174.665 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 8.7 tp10 -78.62 14.58 1.25 Allowed 'General case' 0 CA--C 1.563 1.446 0 C-N-CA 124.175 0.99 . . . . 0.0 112.551 179.853 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.45 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 32.3 mm -96.53 -53.66 7.88 Favored 'Isoleucine or valine' 0 C--N 1.349 0.545 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 177.184 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.517 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 20.1 p -119.65 -107.15 0.37 Allowed 'General case' 0 C--O 1.235 0.31 0 N-CA-C 104.774 -2.306 . . . . 0.0 104.774 173.772 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.517 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.5 166.82 29.68 Favored Glycine 0 CA--C 1.527 0.812 0 N-CA-C 108.568 -1.813 . . . . 0.0 108.568 156.05 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.414 ' H ' ' HG3' ' A' ' 43' ' ' GLN . 74.5 t80 168.45 111.26 0.01 OUTLIER 'General case' 0 C--N 1.346 0.452 0 N-CA-C 102.185 -3.265 . . . . 0.0 102.185 175.789 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -115.05 132.93 56.44 Favored 'General case' 0 C--O 1.238 0.452 0 CA-C-O 121.559 0.695 . . . . 0.0 109.214 -169.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.6 t -149.43 175.28 11.61 Favored 'General case' 0 C--N 1.305 -1.342 0 CA-C-N 113.971 -1.468 . . . . 0.0 109.024 -178.192 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 5.6 ppt_? -103.41 3.25 34.88 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 123.907 0.883 . . . . 0.0 110.891 176.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 28.7 tt0 -127.9 103.74 7.42 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.046 0.938 . . . . 0.0 108.645 -174.281 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.486 ' HB3' HD13 ' A' ' 42' ' ' LEU . 21.0 ptmt -58.6 -28.83 65.96 Favored 'General case' 0 N--CA 1.484 1.273 0 C-N-CA 123.568 0.747 . . . . 0.0 112.57 -177.016 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.19 -39.79 70.01 Favored 'General case' 0 N--CA 1.483 1.21 0 C-N-CA 123.926 0.89 . . . . 0.0 111.829 174.268 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 27.4 t -63.22 -54.64 34.3 Favored 'General case' 0 CA--C 1.549 0.926 0 C-N-CA 123.768 0.827 . . . . 0.0 111.172 -177.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.538 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -74.29 -27.67 60.83 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.98 0.512 . . . . 0.0 112.224 -179.221 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.457 ' O ' ' HG2' ' A' ' 61' ' ' MET . 44.3 t30 -51.48 -51.66 53.16 Favored 'General case' 0 N--CA 1.491 1.584 0 C-N-CA 123.603 0.761 . . . . 0.0 112.17 173.432 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.7 m95 -81.75 -32.41 31.51 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 120.564 0.221 . . . . 0.0 111.028 -177.455 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.538 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 76.0 t60 -48.97 -42.43 37.65 Favored 'General case' 0 CA--C 1.565 1.538 0 N-CA-C 114.102 1.149 . . . . 0.0 114.102 163.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.528 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 17.2 ptm -70.99 -31.87 68.53 Favored 'General case' 0 N--CA 1.499 2.008 0 CA-C-N 119.617 1.099 . . . . 0.0 111.604 174.653 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.402 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 3.0 tppp? -59.24 -27.6 65.92 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.253 0.621 . . . . 0.0 111.351 170.721 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.436 ' HB3' ' HB2' ' A' ' 69' ' ' PHE . 48.0 mmtm -63.12 -36.51 83.84 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 122.624 0.369 . . . . 0.0 110.58 172.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.528 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.6 m-70 -78.56 -33.08 48.03 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.556 0.742 . . . . 0.0 109.86 178.102 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.402 ' HB3' ' HA ' ' A' ' 62' ' ' LYS . 35.5 t70 -84.28 -23.47 30.33 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 114.985 -1.007 . . . . 0.0 110.663 -170.539 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.538 ' HA ' ' HA ' ' A' ' 75' ' ' ASN . . . -108.07 -0.25 21.29 Favored 'General case' 0 N--CA 1.467 0.413 0 C-N-CA 123.975 0.91 . . . . 0.0 111.653 179.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.409 ' HB2' ' HB3' ' A' ' 73' ' ' SER . 5.7 m-20 57.57 17.71 4.14 Favored 'General case' 0 N--CA 1.492 1.632 0 C-N-CA 124.022 0.929 . . . . 0.0 112.26 -174.355 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.2 m -78.21 -11.13 59.9 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.303 1.041 . . . . 0.0 111.412 -178.646 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.436 ' HB2' ' HB3' ' A' ' 63' ' ' LYS . 48.2 t80 -71.33 -41.14 70.21 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.016 0.526 . . . . 0.0 109.699 177.452 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 40.5 t80 -79.3 -86.53 0.07 Allowed 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.057 0.543 . . . . 0.0 110.037 -177.189 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 15.5 mm100 -112.33 -95.33 0.44 Allowed 'General case' 0 N--CA 1.483 1.18 0 CA-C-N 118.645 0.657 . . . . 0.0 109.944 177.375 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 65.6 m-85 -153.88 132.46 12.16 Favored 'General case' 0 C--N 1.349 0.579 0 N-CA-C 105.993 -1.855 . . . . 0.0 105.993 -172.05 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.409 ' HB3' ' HB2' ' A' ' 67' ' ' ASP . 33.4 t -158.22 165.13 35.63 Favored 'General case' 0 C--N 1.313 -1.015 0 C-N-CA 123.349 0.66 . . . . 0.0 110.556 175.802 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.446 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 12.1 t -90.14 125.04 35.31 Favored 'General case' 0 C--N 1.333 -0.12 0 N-CA-C 107.683 -1.228 . . . . 0.0 107.683 172.337 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.538 ' HA ' ' HA ' ' A' ' 66' ' ' ALA . 2.8 t-20 -52.87 -30.68 35.26 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 123.815 0.846 . . . . 0.0 113.153 -178.004 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -103.79 -30.92 2.83 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.982 0 N-CA-C 113.325 0.861 . . . . 0.0 113.325 -163.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.426 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 18.8 p -136.85 -0.31 2.33 Favored 'General case' 0 N--CA 1.49 1.574 0 CA-C-N 118.863 0.756 . . . . 0.0 112.099 -179.824 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 59.56 34.35 81.04 Favored Glycine 0 C--N 1.358 1.779 0 N-CA-C 114.301 0.48 . . . . 0.0 114.301 177.057 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 7.6 tmtt? -63.37 -30.62 71.72 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 124.462 1.105 . . . . 0.0 112.442 -171.078 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 46.7 mmtm 74.13 116.69 0.06 Allowed 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.742 1.217 . . . . 0.0 111.28 175.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.411 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 94.9 m-85 -131.32 159.37 38.08 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.693 0.797 . . . . 0.0 110.269 179.008 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mp0 -71.34 -31.18 67.07 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.422 0.689 . . . . 0.0 111.729 -177.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.426 ' HG3' ' H ' ' A' ' 86' ' ' SER . 18.2 ptpt -134.04 148.06 51.02 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.302 -0.629 . . . . 0.0 109.302 -178.637 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -56.55 -35.56 68.27 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-N 114.27 -1.332 . . . . 0.0 110.916 177.274 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 27.3 t70 -53.98 -45.96 71.56 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 124.149 0.979 . . . . 0.0 111.132 177.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.426 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 19.9 t -69.32 -28.36 66.18 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.043 0.537 . . . . 0.0 110.839 -176.919 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 87.0 t -70.57 -46.77 68.41 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.176 0 C-N-CA 124.019 0.928 . . . . 0.0 109.967 -179.342 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.1 t -71.93 -36.22 57.0 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 CA-C-N 114.215 -1.357 . . . . 0.0 108.819 -175.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.65 -41.36 79.48 Favored 'General case' 0 C--N 1.349 0.576 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.622 178.388 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.9 t60 -70.9 -34.55 71.68 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 115.407 -0.815 . . . . 0.0 110.529 179.848 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -71.52 -38.53 71.1 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.089 0.956 . . . . 0.0 109.351 -174.438 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -69.51 -18.13 63.65 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.778 179.157 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -96.51 -49.78 5.0 Favored 'General case' 0 N--CA 1.49 1.534 0 C-N-CA 123.422 0.689 . . . . 0.0 110.792 179.815 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.0 t -82.79 -32.31 27.79 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 114.887 -1.052 . . . . 0.0 111.255 -170.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.418 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 13.7 m-70 -136.16 54.51 9.8 Favored Pre-proline 0 CA--C 1.573 1.85 0 C-N-CA 122.761 0.424 . . . . 0.0 111.505 -171.702 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.418 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 24.2 Cg_exo -63.5 -36.52 53.81 Favored 'Trans proline' 0 C--N 1.39 2.715 0 C-N-CA 122.038 1.825 . . . . 0.0 111.381 170.475 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 29.7 mm-40 -115.92 97.68 6.23 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 124.941 1.296 . . . . 0.0 107.634 179.892 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.4 p . . . . . 0 C--O 1.253 1.25 0 C-N-CA 124.471 1.108 . . . . 0.0 109.128 176.793 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 85.7 m-70 . . . . . 0 CA--C 1.557 1.247 0 N-CA-C 111.105 0.039 . . . . 0.0 111.105 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.8 ptp -165.44 -41.12 0.03 OUTLIER 'General case' 0 N--CA 1.493 1.72 0 C-N-CA 122.978 0.511 . . . . 0.0 112.261 176.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -139.95 69.88 1.36 Allowed 'General case' 0 N--CA 1.483 1.202 0 N-CA-C 106.242 -1.762 . . . . 0.0 106.242 -178.974 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.402 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 3.2 p-10 -172.95 103.51 0.13 Allowed 'General case' 0 N--CA 1.466 0.351 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.676 -172.507 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 80.8 m-85 -84.76 124.85 32.01 Favored 'General case' 0 C--O 1.238 0.492 0 C-N-CA 123.334 0.654 . . . . 0.0 110.74 -179.035 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.588 HG22 ' H ' ' A' ' 17' ' ' GLU . 5.3 mm -115.03 150.77 16.87 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.659 0 N-CA-C 107.564 -1.273 . . . . 0.0 107.564 -172.633 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.691 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 20.7 t -83.97 -19.1 35.16 Favored 'General case' 0 N--CA 1.486 1.357 0 C-N-CA 123.2 0.6 . . . . 0.0 109.492 176.465 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.588 ' H ' HG22 ' A' ' 15' ' ' ILE . 32.4 tt0 77.06 0.37 3.05 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 125.787 1.635 . . . . 0.0 110.701 173.635 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.4 t80 -136.16 -50.48 0.69 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.107 0.963 . . . . 0.0 108.612 -176.912 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.9 OUTLIER -144.36 77.05 1.53 Allowed 'General case' 0 N--CA 1.471 0.59 0 CA-C-N 114.183 -1.371 . . . . 0.0 110.56 -178.202 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.691 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -168.52 137.37 2.26 Favored 'General case' 0 N--CA 1.475 0.825 0 C-N-CA 123.942 0.897 . . . . 0.0 110.948 167.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.429 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 4.1 ptt180 -70.3 -77.95 0.08 Allowed 'General case' 0 CA--C 1.548 0.867 0 CA-C-N 114.984 -1.007 . . . . 0.0 109.337 168.485 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.429 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -163.44 149.42 11.66 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.449 0.7 . . . . 0.0 110.233 171.087 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.3 m-85 -126.83 152.63 46.73 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 123.379 0.671 . . . . 0.0 110.258 175.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -61.76 -32.62 72.89 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.63 0.772 . . . . 0.0 112.357 176.524 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 88.2 p -147.63 160.04 43.1 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-O 120.887 0.375 . . . . 0.0 111.118 -179.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 57.3 p -56.68 -35.67 68.73 Favored 'General case' 0 N--CA 1.479 1.008 0 CA-C-N 115.138 -0.937 . . . . 0.0 112.259 174.135 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 32.9 m80 -75.9 -35.55 59.77 Favored 'General case' 0 N--CA 1.483 1.216 0 C-N-CA 124.0 0.92 . . . . 0.0 112.501 176.785 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -55.43 -50.41 69.88 Favored 'General case' 0 N--CA 1.492 1.667 0 CA-C-O 122.158 0.98 . . . . 0.0 109.041 169.602 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.3 tp -60.02 -40.2 88.46 Favored 'General case' 0 C--O 1.218 -0.58 0 CA-C-N 113.767 -1.56 . . . . 0.0 112.523 172.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.615 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -56.47 -26.9 55.54 Favored 'General case' 0 N--CA 1.49 1.53 0 C-N-CA 123.617 0.767 . . . . 0.0 112.571 177.321 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.451 HG13 HG21 ' A' ' 50' ' ' THR . 85.5 t -60.35 -44.96 97.04 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.96 0 C-N-CA 123.862 0.865 . . . . 0.0 110.681 173.077 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 8.7 t60 -72.15 -45.98 58.28 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.523 0.729 . . . . 0.0 110.769 172.817 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.615 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 29.8 ttt180 -63.39 -5.13 3.23 Favored 'General case' 0 C--O 1.212 -0.92 0 C-N-CA 125.779 1.632 . . . . 0.0 111.467 -174.844 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 26.5 ptm -47.44 -12.91 0.03 OUTLIER 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 125.338 1.455 . . . . 0.0 114.69 173.923 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -83.99 -52.57 12.63 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.579 0 C-N-CA 124.715 1.206 . . . . 0.0 109.431 173.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -104.7 1.41 29.35 Favored 'General case' 0 N--CA 1.507 2.407 0 N-CA-C 114.418 1.266 . . . . 0.0 114.418 -174.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.7 t -70.74 -49.61 45.04 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 113.397 0.888 . . . . 0.0 113.397 -165.003 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.94 -30.55 3.55 Favored Glycine 0 CA--C 1.538 1.521 0 CA-C-O 120.01 -0.328 . . . . 0.0 112.403 -164.526 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 24.4 mt-10 -103.8 76.87 1.41 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 124.713 1.205 . . . . 0.0 108.444 175.027 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -52.79 131.56 47.59 Favored Pre-proline 0 CA--C 1.558 1.272 0 C-N-CA 123.333 0.653 . . . . 0.0 111.969 178.026 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 95.9 Cg_endo -74.85 -172.87 1.35 Allowed 'Trans proline' 0 C--N 1.375 1.971 0 C-N-CA 122.568 2.179 . . . . 0.0 111.238 171.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 62.4 mt -103.06 99.36 9.24 Favored 'General case' 0 N--CA 1.471 0.616 0 N-CA-C 108.351 -0.981 . . . . 0.0 108.351 -177.33 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -120.51 134.15 55.31 Favored 'General case' 0 CA--C 1.544 0.737 0 N-CA-C 108.25 -1.019 . . . . 0.0 108.25 -166.751 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.431 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 23.2 t -74.66 106.65 6.33 Favored 'General case' 0 CA--C 1.543 0.708 0 C-N-CA 123.896 0.878 . . . . 0.0 110.189 177.359 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -87.11 42.26 1.02 Allowed 'General case' 0 N--CA 1.484 1.242 0 CA-C-O 122.164 0.983 . . . . 0.0 110.493 179.93 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.431 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 4.3 mp -127.78 -2.28 3.86 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.563 0 N-CA-C 107.106 -1.442 . . . . 0.0 107.106 -178.985 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.503 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 6.6 p 173.71 -136.79 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.638 0 N-CA-C 104.517 -2.401 . . . . 0.0 104.517 -168.547 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.503 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -144.39 127.07 2.84 Favored Glycine 0 CA--C 1.522 0.525 0 N-CA-C 107.889 -2.084 . . . . 0.0 107.889 171.184 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 41.9 t80 179.7 112.02 0.04 OUTLIER 'General case' 0 C--O 1.237 0.434 0 N-CA-C 102.147 -3.279 . . . . 0.0 102.147 -167.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.451 HG21 HG13 ' A' ' 31' ' ' VAL . 2.9 m -123.56 144.96 49.24 Favored 'General case' 0 C--O 1.242 0.708 0 CA-C-O 121.612 0.72 . . . . 0.0 109.804 -170.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 81.6 m -147.26 171.16 15.84 Favored 'General case' 0 C--N 1.314 -0.959 0 CA-C-N 113.86 -1.518 . . . . 0.0 110.696 -176.713 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.491 ' H ' ' HD2' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -117.42 -7.2 11.18 Favored 'General case' 0 CA--C 1.543 0.699 0 CA-C-N 114.469 -1.241 . . . . 0.0 108.887 170.198 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 14.2 mm100 -102.83 111.77 24.26 Favored 'General case' 0 C--N 1.35 0.621 0 N-CA-C 107.815 -1.18 . . . . 0.0 107.815 169.128 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -58.32 -33.88 69.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.604 0.761 . . . . 0.0 111.277 -179.719 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.64 -42.82 71.72 Favored 'General case' 0 N--CA 1.475 0.824 0 O-C-N 124.456 1.098 . . . . 0.0 112.413 176.932 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.8 t -55.27 -53.78 51.71 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.967 0.907 . . . . 0.0 112.442 -177.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.596 HD23 ' H ' ' A' ' 57' ' ' LEU . 1.1 pt? -75.86 -27.39 57.78 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.066 0.547 . . . . 0.0 111.567 176.711 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.431 ' O ' ' HG2' ' A' ' 61' ' ' MET . 67.0 t30 -55.1 -44.76 75.22 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 123.783 0.833 . . . . 0.0 113.208 177.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.491 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 66.0 p-90 -82.52 -39.79 21.9 Favored 'General case' 0 N--CA 1.482 1.131 0 O-C-N 122.03 -0.419 . . . . 0.0 110.345 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.555 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 75.9 t60 -48.06 -35.25 10.9 Favored 'General case' 0 CA--C 1.568 1.647 0 N-CA-C 115.175 1.546 . . . . 0.0 115.175 171.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.431 ' HG2' ' O ' ' A' ' 58' ' ' ASN . 23.7 ptp -70.03 -37.56 75.65 Favored 'General case' 0 N--CA 1.491 1.622 0 CA-C-N 119.174 0.897 . . . . 0.0 111.043 174.801 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.491 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 19.4 ttmm -56.93 -37.11 71.04 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.872 0.869 . . . . 0.0 110.699 172.117 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm -61.3 -31.39 71.23 Favored 'General case' 0 N--CA 1.471 0.587 0 CA-C-N 115.358 -0.837 . . . . 0.0 111.654 176.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 84.7 m-70 -73.89 -13.26 60.88 Favored 'General case' 0 N--CA 1.49 1.545 0 C-N-CA 123.302 0.641 . . . . 0.0 111.706 176.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.2 t70 -103.74 -18.01 14.86 Favored 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 109.03 -0.73 . . . . 0.0 109.03 176.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . 0.403 ' O ' ' HB3' ' A' ' 70' ' ' TYR . . . -96.28 -29.22 14.12 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 124.031 0.932 . . . . 0.0 110.978 -171.708 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -82.97 -5.34 59.04 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.507 0.323 . . . . 0.0 111.231 -174.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.41 ' O ' ' HE3' ' A' ' 80' ' ' LYS . 35.5 p -80.73 -61.9 1.83 Allowed 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 123.916 0.886 . . . . 0.0 110.35 -173.582 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.498 ' HD2' ' HG ' ' A' ' 73' ' ' SER . 88.5 m-85 -125.45 -33.16 2.84 Favored 'General case' 0 N--CA 1.49 1.538 0 C-N-CA 123.086 0.554 . . . . 0.0 111.379 177.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.403 ' HB3' ' O ' ' A' ' 66' ' ' ALA . 70.4 t80 -59.69 -32.11 70.2 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.287 1.035 . . . . 0.0 112.466 -169.27 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 19.8 mm-40 -79.57 -81.68 0.11 Allowed 'General case' 0 N--CA 1.476 0.847 0 N-CA-C 108.952 -0.758 . . . . 0.0 108.952 172.344 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 86.2 m-85 -154.76 137.34 15.13 Favored 'General case' 0 C--N 1.345 0.413 0 N-CA-C 105.637 -1.986 . . . . 0.0 105.637 -178.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.498 ' HG ' ' HD2' ' A' ' 69' ' ' PHE . 89.3 p -157.52 165.97 34.18 Favored 'General case' 0 C--N 1.313 -1.0 0 CA-C-O 121.801 0.81 . . . . 0.0 111.133 178.529 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.0 t -93.66 117.4 30.04 Favored 'General case' 0 C--O 1.215 -0.728 0 N-CA-C 105.724 -1.954 . . . . 0.0 105.724 159.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 18.7 m120 -67.41 -9.39 41.22 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.337 0.517 . . . . 0.0 112.299 -174.462 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.625 HD11 ' HE3' ' A' ' 91' ' ' LYS . 3.2 mt -96.69 -37.39 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.199 0.6 . . . . 0.0 111.905 -176.789 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.9 p -139.64 8.79 2.39 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 113.246 0.832 . . . . 0.0 113.246 -176.963 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 54.0 42.8 71.69 Favored Glycine 0 C--N 1.344 1.019 0 C-N-CA 123.884 0.755 . . . . 0.0 114.885 173.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 8.6 tmtm? -66.52 -39.34 88.6 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 113.18 0.807 . . . . 0.0 113.18 179.207 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.41 ' HE3' ' O ' ' A' ' 68' ' ' SER . 11.6 mptt 71.23 117.75 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.775 0 C-N-CA 124.417 1.087 . . . . 0.0 109.853 -173.804 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 87.6 m-85 -124.39 170.63 10.64 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.73 0.812 . . . . 0.0 110.148 177.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.52 ' HG3' ' HG2' ' A' ' 83' ' ' LYS . 13.7 pt-20 -64.29 -41.34 96.93 Favored 'General case' 0 CA--C 1.545 0.759 0 CA-C-N 115.609 -0.723 . . . . 0.0 111.369 173.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.52 ' HG2' ' HG3' ' A' ' 82' ' ' GLU . 17.3 ptpt -142.27 157.64 44.6 Favored 'General case' 0 C--O 1.238 0.457 0 C-N-CA 123.318 0.647 . . . . 0.0 109.554 -177.192 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -67.7 -21.99 65.29 Favored 'General case' 0 CA--C 1.537 0.478 0 CA-C-N 115.329 -0.85 . . . . 0.0 111.64 179.286 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -60.13 -43.98 95.27 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 122.495 0.318 . . . . 0.0 110.76 171.565 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.2 m -66.07 -29.28 69.59 Favored 'General case' 0 CA--C 1.552 1.036 0 C-N-CA 123.178 0.591 . . . . 0.0 111.449 177.006 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 65.3 t -71.37 -49.18 49.3 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.951 0 C-N-CA 124.013 0.925 . . . . 0.0 110.272 -178.938 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 96.0 t -74.34 -33.01 32.7 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.661 0 C-N-CA 124.838 1.255 . . . . 0.0 109.92 -174.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.98 -37.85 89.02 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-N 115.098 -0.956 . . . . 0.0 109.802 173.671 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 4.4 t60 -73.96 -35.35 64.51 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 114.94 -1.027 . . . . 0.0 111.272 174.419 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.625 ' HE3' HD11 ' A' ' 76' ' ' ILE . 85.0 tttt -70.88 -46.7 62.14 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.44 1.096 . . . . 0.0 111.213 -169.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.85 -20.75 66.05 Favored 'General case' 0 CA--C 1.541 0.615 0 CA-C-N 115.298 -0.864 . . . . 0.0 111.684 -178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 50.2 mmtm -99.03 -47.62 5.17 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.117 0.567 . . . . 0.0 111.006 -178.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.2 t -84.84 -20.25 31.17 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 124.018 0.927 . . . . 0.0 111.761 -170.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 58.8 m-70 -136.89 65.59 53.12 Favored Pre-proline 0 CA--C 1.558 1.256 0 C-N-CA 122.975 0.51 . . . . 0.0 110.258 -176.244 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 88.3 Cg_exo -50.71 -39.03 57.26 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 123.255 2.637 . . . . 0.0 113.192 169.131 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -108.31 98.44 7.98 Favored 'General case' 0 C--O 1.241 0.625 0 C-N-CA 124.559 1.144 . . . . 0.0 108.835 -177.656 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 CA--C 1.556 1.211 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.432 169.944 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 98.1 m-70 . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.622 -0.511 . . . . 0.0 109.622 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 88.4 mtp -128.2 -54.18 1.28 Allowed 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 124.078 0.951 . . . . 0.0 108.919 -179.101 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 18.2 tpt180 -126.68 83.15 2.14 Favored 'General case' 0 CA--C 1.544 0.73 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 178.027 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.5 m-20 -143.73 101.92 3.83 Favored 'General case' 0 C--O 1.238 0.453 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 -173.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.7 m-85 -99.48 115.03 28.35 Favored 'General case' 0 N--CA 1.474 0.744 0 N-CA-C 108.403 -0.962 . . . . 0.0 108.403 171.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.465 HG23 ' HB3' ' A' ' 20' ' ' ALA . 31.6 mm -119.36 134.18 63.78 Favored 'Isoleucine or valine' 0 C--O 1.239 0.503 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -170.553 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 43.8 t -57.69 -51.43 69.56 Favored 'General case' 0 CA--C 1.548 0.867 0 C-N-CA 124.264 1.025 . . . . 0.0 110.711 172.895 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 166.14 -54.08 0.0 OUTLIER 'General case' 0 N--CA 1.494 1.772 0 C-N-CA 125.758 1.623 . . . . 0.0 109.367 178.412 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 46.7 t80 -137.46 -51.3 0.63 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 114.629 -1.169 . . . . 0.0 108.308 -169.083 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -90.78 61.39 4.74 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 113.816 -1.538 . . . . 0.0 109.112 179.878 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.465 ' HB3' HG23 ' A' ' 15' ' ' ILE . . . -153.94 128.64 9.38 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 114.759 -1.11 . . . . 0.0 111.02 169.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 44.4 mtp180 -69.79 -79.45 0.06 Allowed 'General case' 0 CA--C 1.55 0.942 0 N-CA-C 107.69 -1.226 . . . . 0.0 107.69 169.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -164.72 140.63 5.78 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.204 1.002 . . . . 0.0 108.613 163.473 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -116.25 145.12 43.39 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.678 0.791 . . . . 0.0 109.044 175.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 11.5 mmpt? -78.78 -9.36 59.42 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 122.857 0.463 . . . . 0.0 112.035 -179.166 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 69.6 m -147.06 147.13 30.32 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.299 0.64 . . . . 0.0 110.77 179.147 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.435 ' HA ' HD23 ' A' ' 29' ' ' LEU . 22.6 t -62.09 -34.34 76.12 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 124.01 0.924 . . . . 0.0 111.844 176.485 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 -73.25 -33.89 65.54 Favored 'General case' 0 N--CA 1.478 0.951 0 CA-C-O 120.803 0.335 . . . . 0.0 110.36 176.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -59.79 -42.9 94.42 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.555 0.742 . . . . 0.0 111.127 176.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.3 OUTLIER -66.0 -34.46 78.14 Favored 'General case' 0 N--CA 1.481 1.116 0 CA-C-N 115.832 -0.622 . . . . 0.0 109.969 175.105 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.18 -27.8 68.67 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.478 0.711 . . . . 0.0 112.324 176.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.486 HG13 HG21 ' A' ' 50' ' ' THR . 79.1 t -63.02 -48.88 85.85 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.279 0 C-N-CA 123.245 0.618 . . . . 0.0 110.976 172.901 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 3.0 t60 -62.56 -35.09 78.37 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.673 0.789 . . . . 0.0 109.943 174.343 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 74.7 ttt180 -66.22 4.34 0.72 Allowed 'General case' 0 CA--C 1.556 1.203 0 C-N-CA 124.975 1.31 . . . . 0.0 112.149 -176.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -46.79 -15.21 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.407 0 C-N-CA 125.519 1.528 . . . . 0.0 114.622 170.524 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -85.32 -49.88 15.14 Favored 'Isoleucine or valine' 0 CA--C 1.568 1.638 0 C-N-CA 125.346 1.458 . . . . 0.0 110.212 173.812 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -101.0 -10.43 20.55 Favored 'General case' 0 N--CA 1.503 2.195 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -169.862 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 7.4 t -72.68 -42.05 64.68 Favored 'General case' 0 N--CA 1.491 1.598 0 N-CA-C 113.836 1.051 . . . . 0.0 113.836 -161.536 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 82.12 -29.85 3.06 Favored Glycine 0 CA--C 1.541 1.693 0 CA-C-O 120.401 -0.11 . . . . 0.0 112.986 -165.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -107.79 77.78 1.15 Allowed 'General case' 0 C--O 1.241 0.612 0 C-N-CA 125.174 1.389 . . . . 0.0 108.027 179.214 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 7.6 ptpp? -49.14 133.1 16.07 Favored Pre-proline 0 N--CA 1.491 1.58 0 C-N-CA 123.925 0.89 . . . . 0.0 112.06 -178.713 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 79.3 Cg_endo -70.88 -178.63 2.87 Favored 'Trans proline' 0 C--N 1.382 2.34 0 C-N-CA 122.709 2.273 . . . . 0.0 111.516 -179.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.403 HD12 ' N ' ' A' ' 42' ' ' LEU . 3.8 mp -102.03 90.04 3.83 Favored 'General case' 0 C--N 1.329 -0.32 0 N-CA-C 107.886 -1.153 . . . . 0.0 107.886 -170.373 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.3 tt0 -121.65 142.92 49.66 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 123.532 0.733 . . . . 0.0 110.177 -172.445 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.523 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 40.8 t -69.85 108.1 3.83 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.527 1.131 . . . . 0.0 109.746 174.344 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -93.55 48.41 1.3 Allowed 'General case' 0 CA--C 1.546 0.799 0 CA-C-O 122.84 1.305 . . . . 0.0 108.492 179.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.523 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -126.53 -9.92 4.79 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 C-N-CA 125.748 1.619 . . . . 0.0 108.049 177.992 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.572 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 5.8 p 179.61 -123.5 0.0 OUTLIER 'General case' 0 C--N 1.348 0.543 0 N-CA-C 102.758 -3.053 . . . . 0.0 102.758 -162.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.572 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.82 143.81 11.23 Favored Glycine 0 C--N 1.308 -1.001 0 CA-C-O 117.342 -1.81 . . . . 0.0 108.978 159.326 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 60.4 t80 177.38 112.36 0.03 OUTLIER 'General case' 0 C--N 1.361 1.093 0 N-CA-C 103.052 -2.944 . . . . 0.0 103.052 178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.486 HG21 HG13 ' A' ' 31' ' ' VAL . 2.7 m -119.19 148.19 43.38 Favored 'General case' 0 C--O 1.237 0.447 0 CA-C-N 118.712 0.687 . . . . 0.0 109.733 -171.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 87.8 m -152.21 169.06 23.39 Favored 'General case' 0 C--N 1.322 -0.599 0 C-N-CA 124.509 1.124 . . . . 0.0 110.256 178.071 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 59.1 ttt180 -84.41 -36.42 22.42 Favored 'General case' 0 CA--C 1.542 0.644 0 C-N-CA 123.503 0.721 . . . . 0.0 110.002 170.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 mm-40 -92.67 130.13 38.39 Favored 'General case' 0 N--CA 1.471 0.611 0 C-N-CA 123.462 0.705 . . . . 0.0 109.306 -173.873 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.7 tmmm? -61.63 -41.44 97.49 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.659 0.784 . . . . 0.0 110.399 -178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.86 -43.18 65.9 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.72 0.808 . . . . 0.0 112.276 178.966 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 22.0 m -51.94 -53.41 41.44 Favored 'General case' 0 CA--C 1.555 1.154 0 C-N-CA 123.705 0.802 . . . . 0.0 112.434 -177.601 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.58 ' H ' HD23 ' A' ' 57' ' ' LEU . 1.3 pt? -77.14 -28.55 54.3 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-O 119.428 -0.32 . . . . 0.0 111.745 174.869 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 63.5 t30 -61.75 -30.91 71.09 Favored 'General case' 0 N--CA 1.496 1.833 0 CA-C-N 118.495 0.588 . . . . 0.0 112.18 -179.525 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 98.3 m95 -79.82 -49.47 11.94 Favored 'General case' 0 N--CA 1.469 0.484 0 N-CA-C 108.496 -0.927 . . . . 0.0 108.496 175.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 74.3 t60 -49.29 -36.82 21.91 Favored 'General case' 0 CA--C 1.567 1.632 0 N-CA-C 115.762 1.764 . . . . 0.0 115.762 173.851 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.4 ' SD ' ' N ' ' A' ' 62' ' ' LYS . 3.6 ppp? -71.02 -35.44 72.02 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-N 119.509 1.05 . . . . 0.0 110.309 177.209 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.4 ' N ' ' SD ' ' A' ' 61' ' ' MET . 30.1 ttmt -67.06 -28.33 68.11 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 123.54 0.736 . . . . 0.0 111.462 172.001 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 28.6 mtpp -61.98 -32.23 72.65 Favored 'General case' 0 N--CA 1.493 1.708 0 C-N-CA 123.091 0.556 . . . . 0.0 112.021 170.182 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 97.3 m-70 -75.02 -22.08 58.7 Favored 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 122.699 0.4 . . . . 0.0 111.558 170.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 33.7 t70 -95.63 -19.42 19.76 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 -175.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -78.2 -23.5 47.51 Favored 'General case' 0 C--O 1.245 0.849 0 C-N-CA 124.702 1.201 . . . . 0.0 110.668 179.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 14.9 t70 64.36 53.98 1.61 Allowed 'General case' 0 C--N 1.361 1.101 0 O-C-N 124.443 1.09 . . . . 0.0 109.5 175.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 46.0 m -91.66 -66.56 0.92 Allowed 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 114.664 -1.153 . . . . 0.0 110.295 -176.2 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 98.6 m-85 -116.57 6.72 13.5 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 123.842 0.857 . . . . 0.0 111.11 -179.392 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 61.1 m-85 -118.3 31.63 6.57 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 108.933 -0.766 . . . . 0.0 108.933 -177.134 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 86.1 mt-30 -69.19 -32.79 72.33 Favored 'General case' 0 N--CA 1.471 0.617 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.793 -166.972 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 64.5 m-85 -133.51 138.4 46.08 Favored 'General case' 0 N--CA 1.455 -0.215 0 N-CA-C 107.314 -1.365 . . . . 0.0 107.314 -177.15 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 73.0 p -156.33 165.09 37.38 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 123.709 0.804 . . . . 0.0 110.694 -178.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.575 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 43.9 t -95.77 116.24 28.6 Favored 'General case' 0 C--O 1.212 -0.871 0 N-CA-C 108.285 -1.006 . . . . 0.0 108.285 -179.523 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 4.1 t-20 -60.96 -15.72 34.65 Favored 'General case' 0 N--CA 1.486 1.335 0 O-C-N 122.062 -0.399 . . . . 0.0 111.578 178.502 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.2 mt -97.2 -37.6 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.889 0 C-N-CA 123.23 0.612 . . . . 0.0 109.818 -177.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.412 ' SG ' ' O ' ' A' ' 77' ' ' CYS . 14.1 p -160.05 56.85 0.36 Allowed 'General case' 0 N--CA 1.486 1.346 0 CA-C-O 121.019 0.438 . . . . 0.0 110.893 -178.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.575 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -25.48 74.26 0.0 OUTLIER Glycine 0 N--CA 1.492 2.392 0 C-N-CA 127.205 2.336 . . . . 0.0 118.265 174.542 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -88.46 -8.76 54.37 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 124.061 0.944 . . . . 0.0 111.682 171.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? 68.83 107.15 0.05 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 124.564 1.146 . . . . 0.0 110.298 173.691 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 63.5 m-85 -110.59 168.05 9.76 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 123.044 0.538 . . . . 0.0 111.643 -172.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -59.66 -28.41 67.23 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 124.071 0.948 . . . . 0.0 112.297 177.931 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 14.0 ptpt -163.66 161.72 23.79 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.351 0.661 . . . . 0.0 110.302 179.196 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.488 ' O ' HG23 ' A' ' 88' ' ' VAL . 25.0 pttm -65.8 -27.71 68.47 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.718 -0.673 . . . . 0.0 110.175 177.235 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.0 t70 -58.87 -39.68 82.12 Favored 'General case' 0 CA--C 1.55 0.976 0 C-N-CA 123.575 0.75 . . . . 0.0 111.354 170.591 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 32.4 m -67.39 -31.72 72.14 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.234 0.613 . . . . 0.0 111.046 174.775 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 89.9 t -73.03 -40.91 59.47 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.081 0 C-N-CA 123.732 0.813 . . . . 0.0 110.347 -177.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.488 HG23 ' O ' ' A' ' 84' ' ' LYS . 58.4 t -73.13 -36.16 49.63 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.288 0 C-N-CA 124.293 1.037 . . . . 0.0 109.225 179.919 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . 0.494 ' O ' ' HG2' ' A' ' 93' ' ' LYS . . . -65.63 -40.68 92.81 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-N 114.892 -1.049 . . . . 0.0 109.418 176.219 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.5 t60 -71.82 -33.93 68.91 Favored 'General case' 0 N--CA 1.483 1.192 0 CA-C-N 114.716 -1.129 . . . . 0.0 110.633 177.509 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.8 ttmt -70.37 -33.5 71.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 124.136 0.974 . . . . 0.0 108.77 -176.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -63.44 -32.79 74.33 Favored 'General case' 0 CA--C 1.544 0.721 0 CA-C-N 114.833 -1.076 . . . . 0.0 111.18 176.07 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.494 ' HG2' ' O ' ' A' ' 89' ' ' ALA . 29.2 mmtp -93.95 -48.49 6.23 Favored 'General case' 0 N--CA 1.489 1.523 0 CA-C-O 120.962 0.41 . . . . 0.0 111.092 -172.13 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.4 t -90.34 -23.74 21.04 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 123.68 0.792 . . . . 0.0 111.239 -171.069 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 31.4 m-70 -132.81 47.42 2.72 Favored Pre-proline 0 CA--C 1.572 1.796 0 CA-C-O 118.911 -0.566 . . . . 0.0 111.447 -173.779 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.3 Cg_endo -67.31 -26.84 41.2 Favored 'Trans proline' 0 C--N 1.39 2.711 0 C-N-CA 121.861 1.707 . . . . 0.0 112.606 -174.945 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -138.65 101.47 4.34 Favored 'General case' 0 CA--C 1.545 0.752 0 C-N-CA 124.618 1.167 . . . . 0.0 107.892 177.357 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.8 p . . . . . 0 CA--C 1.562 1.407 0 C-N-CA 123.984 0.913 . . . . 0.0 109.468 173.481 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 22.6 p80 . . . . . 0 N--CA 1.489 1.484 0 N-CA-C 111.595 0.22 . . . . 0.0 111.595 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.401 ' SD ' ' HE1' ' A' ' 14' ' ' TYR . 17.8 tpt -71.09 78.39 0.67 Allowed 'General case' 0 N--CA 1.481 1.078 0 N-CA-C 108.906 -0.776 . . . . 0.0 108.906 172.881 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 26.5 ttm180 -164.68 93.57 0.65 Allowed 'General case' 0 C--O 1.241 0.638 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 -174.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 56.86 90.04 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 124.484 1.113 . . . . 0.0 111.692 172.336 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.401 ' HE1' ' SD ' ' A' ' 11' ' ' MET . 64.9 m-85 -77.91 121.77 24.6 Favored 'General case' 0 C--O 1.239 0.524 0 CA-C-N 114.863 -1.062 . . . . 0.0 110.599 -176.793 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.419 HG22 ' H ' ' A' ' 17' ' ' GLU . 20.6 mm -112.81 117.18 54.66 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.139 -171.017 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.438 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 46.6 t -57.7 -23.65 52.78 Favored 'General case' 0 CA--C 1.561 1.37 0 C-N-CA 124.527 1.131 . . . . 0.0 111.572 172.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.419 ' H ' HG22 ' A' ' 15' ' ' ILE . 42.3 tt0 115.93 -24.84 0.01 OUTLIER 'General case' 0 N--CA 1.51 2.53 0 C-N-CA 127.287 2.235 . . . . 0.0 111.18 164.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -133.81 -48.65 0.81 Allowed 'General case' 0 N--CA 1.475 0.813 0 CA-C-O 121.809 0.814 . . . . 0.0 109.091 -177.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.1 p -114.92 64.02 0.68 Allowed 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 114.503 -1.226 . . . . 0.0 110.209 -178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.438 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -162.98 112.86 1.38 Allowed 'General case' 0 N--CA 1.47 0.549 0 CA-C-N 114.774 -1.103 . . . . 0.0 110.176 164.564 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 7.3 ptm180 -68.29 -45.17 73.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 169.573 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -172.58 148.97 2.03 Favored 'General case' 0 C--N 1.362 1.138 0 C-N-CA 123.772 0.829 . . . . 0.0 110.971 157.929 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 82.0 m-85 -118.1 148.04 42.69 Favored 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 166.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttmt -65.65 -25.54 67.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.582 0.586 . . . . 0.0 112.582 -178.15 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.4 m -147.02 156.93 43.42 Favored 'General case' 0 C--O 1.238 0.467 0 CA-C-O 120.964 0.411 . . . . 0.0 111.827 -175.203 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 22.3 p -59.11 -37.24 76.71 Favored 'General case' 0 N--CA 1.48 1.042 0 CA-C-N 114.664 -1.153 . . . . 0.0 111.537 170.277 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.402 ' O ' HG23 ' A' ' 31' ' ' VAL . 15.2 m-70 -69.37 -39.26 78.14 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.867 0.867 . . . . 0.0 109.95 177.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.4 t-20 -60.21 -51.06 71.19 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.52 1.128 . . . . 0.0 110.623 179.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -66.41 -33.54 75.94 Favored 'General case' 0 N--CA 1.477 0.92 0 CA-C-N 115.178 -0.919 . . . . 0.0 110.86 179.043 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -58.85 -32.96 69.91 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.962 0.905 . . . . 0.0 112.207 179.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.566 HG21 ' HE ' ' A' ' 52' ' ' ARG . 25.8 t -68.32 -40.21 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.433 0.458 . . . . 0.0 110.338 179.587 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 1.7 t60 -71.82 -39.27 69.92 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.542 0.737 . . . . 0.0 109.69 175.717 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 29.7 ttt180 -64.08 -6.47 6.48 Favored 'General case' 0 CA--C 1.549 0.934 0 C-N-CA 125.22 1.408 . . . . 0.0 111.614 -176.359 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.505 ' SD ' ' HB ' ' A' ' 50' ' ' THR . 25.9 ptt? -46.94 -15.19 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 115.245 1.572 . . . . 0.0 115.245 177.524 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -84.71 -54.4 8.78 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.408 0 C-N-CA 125.226 1.41 . . . . 0.0 109.406 176.677 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -102.96 5.12 38.16 Favored 'General case' 0 N--CA 1.499 2.011 0 C-N-CA 123.799 0.84 . . . . 0.0 112.98 -175.046 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -62.39 -35.78 80.23 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 122.747 0.419 . . . . 0.0 112.085 -168.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 81.57 -25.24 3.96 Favored Glycine 0 C--N 1.35 1.33 0 O-C-N 123.019 0.199 . . . . 0.0 112.719 -177.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 31.0 mt-10 -128.47 89.22 2.86 Favored 'General case' 0 C--N 1.349 0.557 0 N-CA-C 106.731 -1.581 . . . . 0.0 106.731 177.526 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -53.56 112.73 3.97 Favored Pre-proline 0 N--CA 1.49 1.554 0 C-N-CA 123.946 0.898 . . . . 0.0 110.651 -179.467 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 35.4 Cg_endo -63.02 -67.35 0.04 OUTLIER 'Trans proline' 0 C--N 1.385 2.459 0 C-N-CA 122.682 2.255 . . . . 0.0 112.124 -173.43 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.5 ' HB3' HD21 ' A' ' 57' ' ' LEU . 85.4 mt -145.67 96.52 2.83 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.395 1.078 . . . . 0.0 108.458 -176.866 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 47.8 tt0 -132.52 143.06 49.49 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 123.372 0.669 . . . . 0.0 110.545 -176.734 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 7.4 t -63.91 110.53 2.13 Favored 'General case' 0 N--CA 1.473 0.675 0 C-N-CA 124.335 1.054 . . . . 0.0 110.311 174.463 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -84.92 29.73 0.62 Allowed 'General case' 0 CA--C 1.563 1.445 0 C-N-CA 123.845 0.858 . . . . 0.0 111.487 -178.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 44.5 mm -117.35 -56.49 3.84 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.783 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 -179.883 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.497 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.7 p -113.71 -117.67 0.32 Allowed 'General case' 0 C--O 1.239 0.507 0 N-CA-C 102.447 -3.168 . . . . 0.0 102.447 166.912 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.497 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -145.96 163.74 28.29 Favored Glycine 0 C--N 1.313 -0.696 0 N-CA-C 109.369 -1.492 . . . . 0.0 109.369 156.32 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.6 t80 172.33 112.55 0.01 OUTLIER 'General case' 0 C--O 1.24 0.566 0 N-CA-C 102.458 -3.164 . . . . 0.0 102.458 -178.088 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.505 ' HB ' ' SD ' ' A' ' 34' ' ' MET . 3.4 m -114.3 138.05 51.01 Favored 'General case' 0 C--N 1.322 -0.603 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 -173.076 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.5 t -144.97 162.06 37.84 Favored 'General case' 0 C--N 1.314 -0.947 0 CA-C-N 115.156 -0.929 . . . . 0.0 110.761 -179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.566 ' HE ' HG21 ' A' ' 31' ' ' VAL . 38.0 ttm180 -76.98 -31.61 56.65 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.913 -1.039 . . . . 0.0 110.575 175.828 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.527 HE21 ' HB3' ' A' ' 55' ' ' ALA . 53.5 tt0 -106.71 122.16 45.8 Favored 'General case' 0 C--O 1.24 0.58 0 C-N-CA 123.701 0.8 . . . . 0.0 109.685 -178.877 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 24.3 ttmm -49.43 -47.59 47.98 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.63 1.172 . . . . 0.0 111.974 177.637 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.527 ' HB3' HE21 ' A' ' 53' ' ' GLN . . . -53.44 -31.85 47.21 Favored 'General case' 0 N--CA 1.486 1.367 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 -176.127 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 32.2 t -63.43 -56.04 19.4 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 122.676 0.39 . . . . 0.0 111.371 -179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.5 HD21 ' HB3' ' A' ' 42' ' ' LEU . 0.5 OUTLIER -75.06 -30.72 61.07 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 122.958 0.503 . . . . 0.0 111.646 179.407 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -52.02 -48.58 64.43 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.606 1.162 . . . . 0.0 112.776 175.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.439 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 8.8 m95 -77.06 -42.41 38.47 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 109.358 -0.608 . . . . 0.0 109.358 -178.944 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.431 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 59.6 t60 -46.42 -41.36 13.63 Favored 'General case' 0 CA--C 1.569 1.678 0 N-CA-C 113.809 1.04 . . . . 0.0 113.809 168.708 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.524 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 75.0 mtm -71.41 -43.15 67.31 Favored 'General case' 0 N--CA 1.485 1.311 0 CA-C-N 118.217 0.462 . . . . 0.0 111.562 177.339 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.3 ttpp -60.31 -25.36 65.72 Favored 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 123.025 0.53 . . . . 0.0 111.855 172.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 32.6 mmmt -62.4 -38.59 90.24 Favored 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 122.924 0.49 . . . . 0.0 110.559 171.956 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.524 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 98.6 m-70 -65.17 -26.62 68.24 Favored 'General case' 0 N--CA 1.496 1.856 0 C-N-CA 123.051 0.54 . . . . 0.0 111.085 172.154 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -90.15 -11.2 41.86 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.228 0.611 . . . . 0.0 109.776 -179.465 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.2 -48.76 32.44 Favored 'General case' 0 C--N 1.347 0.483 0 C-N-CA 123.693 0.797 . . . . 0.0 109.141 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 73.28 -26.21 0.19 Allowed 'General case' 0 N--CA 1.496 1.864 0 C-N-CA 124.668 1.187 . . . . 0.0 113.566 176.902 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.3 t -62.75 -9.98 11.19 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 124.713 1.205 . . . . 0.0 113.503 -179.188 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -120.04 -21.73 6.96 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.98 0.912 . . . . 0.0 109.527 -176.201 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.9 m-85 -111.06 -9.69 14.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.256 0.622 . . . . 0.0 112.029 -169.224 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.5 mm-40 -118.93 8.73 11.74 Favored 'General case' 0 N--CA 1.483 1.222 0 C-N-CA 123.289 0.636 . . . . 0.0 111.697 -177.78 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 90.3 m-85 -139.16 133.48 31.51 Favored 'General case' 0 C--O 1.236 0.344 0 N-CA-C 107.088 -1.449 . . . . 0.0 107.088 -175.295 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 20.8 p -161.96 121.34 2.41 Favored 'General case' 0 C--N 1.321 -0.646 0 C-N-CA 124.499 1.12 . . . . 0.0 109.148 -174.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.617 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 0.9 OUTLIER -72.16 135.56 46.2 Favored 'General case' 0 CA--C 1.545 0.774 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 167.062 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 16.3 m120 -59.5 -27.07 65.82 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.975 0.91 . . . . 0.0 113.409 -174.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.426 HD11 ' HA ' ' A' ' 98' ' ' VAL . 2.6 mt -113.08 -38.55 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.751 0 C-N-CA 122.919 0.487 . . . . 0.0 110.308 -170.237 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.9 p -150.37 64.37 0.95 Allowed 'General case' 0 C--N 1.353 0.759 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 -177.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.617 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -35.98 77.86 0.0 OUTLIER Glycine 0 C--N 1.355 1.627 0 C-N-CA 125.13 1.347 . . . . 0.0 116.407 167.815 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 11.6 tmtt? -68.41 -28.75 67.36 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 124.127 0.971 . . . . 0.0 110.989 173.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 4.1 mptp? 74.52 111.37 0.07 Allowed 'General case' 0 C--N 1.365 1.28 0 C-N-CA 124.924 1.29 . . . . 0.0 110.387 -174.819 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 69.2 m-85 -116.6 155.82 28.06 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 114.645 -1.161 . . . . 0.0 109.17 -175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.81 -29.97 66.29 Favored 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 112.796 0.665 . . . . 0.0 112.796 -178.536 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -135.4 150.96 50.02 Favored 'General case' 0 C--O 1.245 0.85 0 C-N-CA 122.82 0.448 . . . . 0.0 109.859 -177.938 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 55.8 mtpt -60.73 -30.4 69.96 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.977 0.911 . . . . 0.0 111.052 177.963 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -53.16 -45.8 68.63 Favored 'General case' 0 N--CA 1.476 0.855 0 O-C-N 123.828 0.705 . . . . 0.0 110.874 174.209 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 63.0 m -68.03 -30.46 69.7 Favored 'General case' 0 CA--C 1.547 0.863 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 35.3 t -74.56 -46.42 42.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.393 0 C-N-CA 123.203 0.601 . . . . 0.0 110.024 -176.46 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.1 t -73.32 -37.26 51.17 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.89 0 CA-C-N 114.09 -1.414 . . . . 0.0 109.664 -175.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.65 -40.73 92.8 Favored 'General case' 0 N--CA 1.475 0.821 0 O-C-N 124.221 0.951 . . . . 0.0 109.354 176.633 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 39.0 t60 -68.99 -37.72 78.9 Favored 'General case' 0 N--CA 1.483 1.2 0 CA-C-N 115.232 -0.894 . . . . 0.0 111.322 -179.144 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -70.8 -41.19 71.94 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 123.804 0.841 . . . . 0.0 109.835 -179.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.98 -28.72 68.49 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.273 0.629 . . . . 0.0 111.301 176.605 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -82.13 -53.53 6.01 Favored 'General case' 0 C--O 1.238 0.499 0 C-N-CA 124.539 1.136 . . . . 0.0 110.965 -174.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.03 -15.57 16.73 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.221 -0.899 . . . . 0.0 111.213 -166.524 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.0 m-70 -137.11 52.73 5.94 Favored Pre-proline 0 CA--C 1.57 1.747 0 N-CA-C 112.754 0.65 . . . . 0.0 112.754 -173.213 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo -60.83 -22.35 73.5 Favored 'Trans proline' 0 C--N 1.391 2.777 0 C-N-CA 122.121 1.881 . . . . 0.0 112.379 166.008 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 38.4 tt0 -115.85 96.47 5.61 Favored 'General case' 0 C--O 1.239 0.509 0 N-CA-C 106.925 -1.509 . . . . 0.0 106.925 171.232 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.426 ' HA ' HD11 ' A' ' 76' ' ' ILE . 69.7 t . . . . . 0 C--O 1.255 1.371 0 CA-C-N 115.061 -0.972 . . . . 0.0 109.913 177.344 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 96.8 m-70 . . . . . 0 N--CA 1.481 1.119 0 CA-C-O 118.975 -0.536 . . . . 0.0 111.051 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.0 mtm 62.65 29.56 16.88 Favored 'General case' 0 N--CA 1.495 1.808 0 C-N-CA 124.345 1.058 . . . . 0.0 110.913 -175.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.525 HH11 ' HA ' ' A' ' 24' ' ' LYS . 34.4 ttp85 -169.36 71.22 0.07 Allowed 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 125.588 1.555 . . . . 0.0 106.821 -174.127 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 7.8 m-20 -141.13 97.38 3.16 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 -169.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.483 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 81.7 m-85 -91.55 108.03 19.61 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 115.426 -0.806 . . . . 0.0 109.164 179.636 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 13.1 mm -109.15 149.74 12.2 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.673 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 -175.189 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.628 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 25.4 t -94.01 -23.86 17.86 Favored 'General case' 0 N--CA 1.482 1.171 0 C-N-CA 123.333 0.653 . . . . 0.0 110.505 -176.332 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 113.97 -27.18 0.01 OUTLIER 'General case' 0 N--CA 1.503 2.202 0 C-N-CA 128.533 2.733 . . . . 0.0 111.024 175.109 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 7.6 t80 -135.88 -51.66 0.73 Allowed 'General case' 0 N--CA 1.48 1.029 0 CA-C-O 121.652 0.739 . . . . 0.0 109.927 179.752 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.6 p -113.34 57.27 0.68 Allowed 'General case' 0 N--CA 1.482 1.172 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.833 -172.481 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.628 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -159.91 116.12 2.47 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.962 0.905 . . . . 0.0 109.578 165.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 6.7 ptm180 -68.34 -48.92 63.55 Favored 'General case' 0 CA--C 1.551 1.014 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 174.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -170.07 164.28 9.33 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 124.368 1.067 . . . . 0.0 109.627 160.62 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.483 ' HB2' ' HB2' ' A' ' 14' ' ' TYR . 88.5 m-85 -131.27 143.54 50.63 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.516 0.726 . . . . 0.0 109.815 167.731 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.525 ' HA ' HH11 ' A' ' 12' ' ' ARG . 25.9 ttpp -74.81 -24.83 58.69 Favored 'General case' 0 CA--C 1.543 0.689 0 C-N-CA 124.071 0.948 . . . . 0.0 110.791 173.032 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.5 t -139.85 140.2 36.49 Favored 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.692 0.797 . . . . 0.0 110.336 -171.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 35.8 t -67.78 -25.88 65.83 Favored 'General case' 0 CA--C 1.551 1.0 0 CA-C-N 115.388 -0.823 . . . . 0.0 111.234 172.687 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.404 ' O ' HG23 ' A' ' 31' ' ' VAL . 26.4 m80 -70.44 -38.19 74.47 Favored 'General case' 0 N--CA 1.488 1.445 0 C-N-CA 122.816 0.446 . . . . 0.0 110.799 174.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.66 -44.79 85.24 Favored 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 122.136 0.97 . . . . 0.0 109.617 176.565 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 2.6 tp -60.64 -37.35 81.2 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 113.661 -1.609 . . . . 0.0 110.999 174.709 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -61.42 -33.68 74.12 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.644 0.777 . . . . 0.0 112.23 175.272 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.689 HG13 ' HB ' ' A' ' 50' ' ' THR . 87.3 t -62.94 -44.74 99.82 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.178 0 C-N-CA 123.649 0.78 . . . . 0.0 110.468 176.513 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 31.8 t60 -69.27 -38.02 78.16 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.84 0.856 . . . . 0.0 110.732 173.896 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.498 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 37.3 ttp180 -70.04 0.74 5.51 Favored 'General case' 0 C--O 1.21 -0.986 0 C-N-CA 124.319 1.047 . . . . 0.0 111.743 -172.471 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.7 ptt? -46.43 -17.56 0.04 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 C-N-CA 124.895 1.278 . . . . 0.0 114.319 172.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.7 OUTLIER -86.17 -54.17 8.89 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.676 0 C-N-CA 124.427 1.091 . . . . 0.0 109.449 174.041 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -96.39 7.98 45.15 Favored 'General case' 0 N--CA 1.505 2.291 0 C-N-CA 123.887 0.875 . . . . 0.0 111.658 -170.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.498 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 3.6 t -56.3 -64.92 0.7 Allowed 'General case' 0 N--CA 1.485 1.297 0 N-CA-C 115.07 1.507 . . . . 0.0 115.07 -156.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 69.6 35.69 75.02 Favored Glycine 0 N--CA 1.474 1.188 0 N-CA-C 111.061 -0.816 . . . . 0.0 111.061 -173.065 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.409 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 38.4 mt-10 -146.1 -38.01 0.24 Allowed 'General case' 0 N--CA 1.492 1.628 0 C-N-CA 125.567 1.547 . . . . 0.0 108.122 -169.46 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 57.0 mtpt 72.16 78.21 0.2 Allowed Pre-proline 0 C--N 1.358 0.95 0 C-N-CA 125.483 1.513 . . . . 0.0 109.9 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.0 Cg_endo -78.43 170.01 19.09 Favored 'Trans proline' 0 C--N 1.383 2.381 0 C-N-CA 122.82 2.347 . . . . 0.0 111.384 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 70.7 mt -111.48 140.62 45.92 Favored 'General case' 0 C--N 1.324 -0.504 0 C-N-CA 123.674 0.79 . . . . 0.0 109.757 -173.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -125.92 143.66 50.99 Favored 'General case' 0 N--CA 1.474 0.738 0 N-CA-C 107.837 -1.171 . . . . 0.0 107.837 -173.454 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 8.0 t -63.56 106.52 0.96 Allowed 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 109.58 -0.526 . . . . 0.0 109.58 177.909 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 37.4 mm-40 -53.43 -29.18 33.98 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 124.909 1.283 . . . . 0.0 112.027 177.842 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 43.6 mm -74.29 -47.9 38.87 Favored 'Isoleucine or valine' 0 C--O 1.241 0.613 0 C-N-CA 123.17 0.588 . . . . 0.0 109.985 -176.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.602 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.0 p -142.96 -89.36 0.13 Allowed 'General case' 0 CA--C 1.55 0.951 0 CA-C-O 120.586 0.231 . . . . 0.0 111.109 179.178 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.602 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -156.23 132.81 3.44 Favored Glycine 0 C--N 1.339 0.75 0 CA-C-O 116.838 -2.09 . . . . 0.0 109.709 -170.769 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 67.1 t80 168.1 112.91 0.01 OUTLIER 'General case' 0 C--N 1.353 0.752 0 N-CA-C 103.065 -2.939 . . . . 0.0 103.065 170.652 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.689 ' HB ' HG13 ' A' ' 31' ' ' VAL . 2.9 m -113.63 134.98 54.41 Favored 'General case' 0 C--O 1.237 0.395 0 N-CA-C 108.801 -0.814 . . . . 0.0 108.801 -175.368 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.599 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 4.8 p -159.62 159.16 32.82 Favored 'General case' 0 C--N 1.318 -0.795 0 O-C-N 124.089 0.868 . . . . 0.0 110.891 176.582 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 25.9 mmm180 -81.46 -10.68 59.44 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 124.319 1.048 . . . . 0.0 111.252 176.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.7 mt-30 -103.01 109.31 20.8 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.392 1.077 . . . . 0.0 108.994 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -52.06 -42.47 63.17 Favored 'General case' 0 N--CA 1.49 1.561 0 C-N-CA 123.467 0.707 . . . . 0.0 111.712 175.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.89 -41.73 64.63 Favored 'General case' 0 CA--C 1.556 1.186 0 O-C-N 124.698 1.249 . . . . 0.0 111.999 177.076 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.599 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 20.0 t -61.19 -52.63 64.01 Favored 'General case' 0 CA--C 1.552 1.043 0 C-N-CA 123.643 0.777 . . . . 0.0 111.653 -173.502 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.478 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.9 OUTLIER -74.25 -33.42 63.32 Favored 'General case' 0 N--CA 1.483 1.203 0 CA-C-O 119.404 -0.332 . . . . 0.0 111.315 178.083 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.3 t30 -52.35 -42.29 63.77 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.826 0.851 . . . . 0.0 112.637 173.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 24.2 m95 -80.14 -38.49 31.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 109.941 -0.392 . . . . 0.0 109.941 -177.929 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 56.8 t60 -48.26 -34.19 9.93 Favored 'General case' 0 CA--C 1.57 1.72 0 N-CA-C 113.672 0.99 . . . . 0.0 113.672 162.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 65.3 mtt -71.41 -35.14 70.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 172.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 35.8 ttpt -61.03 -27.41 68.31 Favored 'General case' 0 N--CA 1.489 1.503 0 CA-C-O 121.142 0.496 . . . . 0.0 111.187 167.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.519 ' HE2' ' HB3' ' A' ' 70' ' ' TYR . 52.2 mtpt -68.98 -31.15 69.79 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.845 0.458 . . . . 0.0 110.243 173.735 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 74.8 m-70 -70.58 -20.34 62.78 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 123.41 0.684 . . . . 0.0 111.261 173.282 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 28.9 t70 -69.68 -39.15 77.15 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 122.922 0.489 . . . . 0.0 110.547 -177.601 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -42.43 63.04 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.12 0.568 . . . . 0.0 109.803 171.195 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 23.1 t70 85.72 -70.07 0.03 OUTLIER 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 113.881 -1.509 . . . . 0.0 111.311 165.011 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 33.9 t -61.56 -34.13 75.05 Favored 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 124.567 1.147 . . . . 0.0 113.458 -167.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 54.8 m-85 -138.45 7.34 2.58 Favored 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 123.375 0.67 . . . . 0.0 111.603 -171.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.519 ' HB3' ' HE2' ' A' ' 63' ' ' LYS . 58.5 m-85 60.01 2.3 0.4 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 115.599 1.703 . . . . 0.0 115.599 176.561 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 28.8 mt-30 -93.63 -110.91 0.11 Allowed 'General case' 0 N--CA 1.472 0.659 0 N-CA-C 109.009 -0.737 . . . . 0.0 109.009 176.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.447 ' O ' ' HA ' ' A' ' 80' ' ' LYS . 99.0 m-85 -144.22 137.55 27.42 Favored 'General case' 0 C--N 1.346 0.435 0 N-CA-C 105.61 -1.996 . . . . 0.0 105.61 179.369 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 61.0 p -140.73 132.56 27.5 Favored 'General case' 0 C--N 1.322 -0.59 0 C-N-CA 123.301 0.64 . . . . 0.0 110.09 -169.082 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.0 t -76.35 126.5 31.11 Favored 'General case' 0 N--CA 1.468 0.433 0 CA-C-N 114.62 -1.173 . . . . 0.0 108.046 172.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.0 t30 -62.45 -27.83 69.38 Favored 'General case' 0 N--CA 1.484 1.244 0 CA-C-N 118.526 0.603 . . . . 0.0 111.462 -179.59 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.672 HD13 HG21 ' A' ' 98' ' ' VAL . 2.8 mt -88.24 -44.08 15.57 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.958 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.968 -170.785 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -131.69 -2.73 3.74 Favored 'General case' 0 N--CA 1.488 1.445 0 CA-C-N 119.231 0.923 . . . . 0.0 112.335 -177.266 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.17 31.72 56.51 Favored Glycine 0 C--N 1.362 2.001 0 N-CA-C 115.004 0.762 . . . . 0.0 115.004 174.493 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 2.5 ttpp -62.61 -23.4 67.03 Favored 'General case' 0 CA--C 1.557 1.216 0 N-CA-C 113.317 0.858 . . . . 0.0 113.317 -171.598 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.447 ' HA ' ' O ' ' A' ' 72' ' ' PHE . 43.9 mmtm 77.8 118.62 0.06 Allowed 'General case' 0 N--CA 1.487 1.403 0 C-N-CA 124.826 1.25 . . . . 0.0 111.228 175.762 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -125.7 162.57 24.73 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 123.69 0.796 . . . . 0.0 111.832 -176.813 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 8.0 tp10 -72.3 -32.5 66.65 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.467 -0.788 . . . . 0.0 112.856 177.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 24.1 pttm -150.14 165.34 33.13 Favored 'General case' 0 C--N 1.355 0.81 0 CA-C-O 121.014 0.435 . . . . 0.0 111.395 176.593 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 57.6 mtpt -56.13 -40.66 74.11 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.931 1.293 . . . . 0.0 111.528 -179.186 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 20.9 t70 -53.87 -41.97 68.1 Favored 'General case' 0 N--CA 1.481 1.117 0 O-C-N 124.045 0.841 . . . . 0.0 111.503 179.34 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 14.0 m -66.13 -32.49 73.97 Favored 'General case' 0 CA--C 1.546 0.798 0 CA-C-N 116.152 -0.476 . . . . 0.0 111.647 -179.518 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 4.9 t -76.3 -42.9 36.97 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.275 0 C-N-CA 123.728 0.811 . . . . 0.0 110.11 -174.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 98.5 t -70.7 -41.39 77.63 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 CA-C-N 114.237 -1.347 . . . . 0.0 109.301 -174.418 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -67.74 -36.58 80.83 Favored 'General case' 0 C--N 1.352 0.676 0 CA-C-N 113.966 -1.47 . . . . 0.0 109.742 178.858 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.4 t60 -68.25 -45.15 73.99 Favored 'General case' 0 C--O 1.213 -0.842 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.572 179.434 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.5 ttpt -70.16 -40.26 74.85 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 123.693 0.797 . . . . 0.0 109.715 -167.955 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -58.3 -30.38 66.6 Favored 'General case' 0 CA--C 1.549 0.917 0 CA-C-N 114.252 -1.34 . . . . 0.0 112.061 177.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 95.6 mttt -102.76 -40.64 6.49 Favored 'General case' 0 N--CA 1.49 1.552 0 C-N-CA 123.46 0.704 . . . . 0.0 111.742 -171.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.2 t -85.95 -17.78 34.45 Favored 'General case' 0 N--CA 1.471 0.587 0 C-N-CA 124.611 1.165 . . . . 0.0 111.158 -170.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 64.5 m-70 -134.88 58.09 25.93 Favored Pre-proline 0 CA--C 1.567 1.629 0 C-N-CA 123.006 0.522 . . . . 0.0 111.043 -176.498 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 50.0 Cg_endo -67.21 -39.99 12.15 Favored 'Trans proline' 0 C--N 1.389 2.679 0 C-N-CA 122.221 1.948 . . . . 0.0 111.371 175.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 4.3 mp0 -111.01 94.53 5.04 Favored 'General case' 0 C--N 1.353 0.756 0 N-CA-C 107.383 -1.34 . . . . 0.0 107.383 173.542 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.672 HG21 HD13 ' A' ' 76' ' ' ILE . 3.0 p . . . . . 0 C--O 1.248 1.011 0 C-N-CA 124.224 1.01 . . . . 0.0 109.711 174.55 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.8 p-80 . . . . . 0 CA--C 1.553 1.072 0 CA-C-O 120.952 0.406 . . . . 0.0 110.742 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.427 ' HG3' ' HD2' ' A' ' 12' ' ' ARG . 15.6 ptt? -157.22 -40.29 0.07 Allowed 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.729 0.811 . . . . 0.0 111.056 -179.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.427 ' HD2' ' HG3' ' A' ' 11' ' ' MET . 5.1 mpt_? -86.0 46.6 1.34 Allowed 'General case' 0 N--CA 1.496 1.859 0 CA-C-O 121.398 0.618 . . . . 0.0 109.633 172.463 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.1 m-20 -128.14 94.23 3.86 Favored 'General case' 0 N--CA 1.465 0.318 0 C-N-CA 124.196 0.998 . . . . 0.0 108.817 -167.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 53.8 m-85 -77.3 118.77 20.11 Favored 'General case' 0 C--N 1.319 -0.73 0 C-N-CA 126.111 1.764 . . . . 0.0 109.077 176.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.643 HG22 ' H ' ' A' ' 17' ' ' GLU . 8.2 mm -114.64 151.13 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 N-CA-C 109.383 -0.599 . . . . 0.0 109.383 -173.198 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.648 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 2.2 t -81.61 -23.53 36.97 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 123.712 0.805 . . . . 0.0 111.281 174.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.643 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.1 tt0 85.87 -5.46 0.82 Allowed 'General case' 0 N--CA 1.493 1.688 0 C-N-CA 125.491 1.516 . . . . 0.0 110.288 174.202 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 9.2 t80 -134.76 -51.01 0.78 Allowed 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.447 0.699 . . . . 0.0 109.311 -176.517 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.0 OUTLIER -144.27 79.37 1.61 Allowed 'General case' 0 N--CA 1.472 0.644 0 CA-C-N 114.572 -1.195 . . . . 0.0 111.003 -179.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.648 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -163.24 129.29 3.25 Favored 'General case' 0 N--CA 1.47 0.557 0 C-N-CA 124.748 1.219 . . . . 0.0 109.293 164.72 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.469 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 35.3 ptt180 -66.61 -59.68 3.39 Favored 'General case' 0 CA--C 1.554 1.11 0 O-C-N 124.184 0.927 . . . . 0.0 108.731 175.694 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.469 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -176.22 146.45 0.66 Allowed 'General case' 0 C--N 1.354 0.777 0 C-N-CA 124.941 1.296 . . . . 0.0 108.519 169.61 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 77.1 m-85 -119.34 139.13 52.47 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 173.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.4 pttp -89.42 0.38 56.89 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.313 0.245 . . . . 0.0 110.863 174.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 38.6 m -137.75 133.01 33.61 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.282 0.633 . . . . 0.0 110.052 178.092 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.8 p -61.79 -38.5 88.32 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 124.382 1.073 . . . . 0.0 111.526 176.325 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.481 ' O ' HG23 ' A' ' 31' ' ' VAL . 51.7 m-70 -62.48 -40.17 95.8 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.993 0.517 . . . . 0.0 111.47 177.546 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -60.79 -45.11 95.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 123.718 0.807 . . . . 0.0 110.175 -178.682 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -62.42 -40.96 98.26 Favored 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 114.518 -1.219 . . . . 0.0 110.957 176.355 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.05 -30.32 71.27 Favored 'General case' 0 CA--C 1.557 1.246 0 C-N-CA 123.227 0.611 . . . . 0.0 111.896 179.578 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.481 HG23 ' O ' ' A' ' 27' ' ' HIS . 81.2 t -65.98 -41.54 89.99 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.46 0.704 . . . . 0.0 110.465 174.422 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 45.4 t60 -68.44 -40.39 81.16 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 123.559 0.744 . . . . 0.0 110.83 174.169 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 35.3 ttm180 -65.09 -3.34 3.57 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.928 1.291 . . . . 0.0 112.128 -175.116 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 27.0 ptt? -45.16 -24.41 0.25 Allowed 'General case' 0 N--CA 1.496 1.833 0 C-N-CA 125.193 1.397 . . . . 0.0 114.115 174.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.6 tp -87.2 -40.47 13.92 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.585 0 C-N-CA 124.323 1.049 . . . . 0.0 110.598 -178.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 13.7 m-70 -98.57 -19.04 17.82 Favored 'General case' 0 N--CA 1.497 1.895 0 N-CA-C 112.626 0.602 . . . . 0.0 112.626 -172.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -62.03 -49.06 77.51 Favored 'General case' 0 N--CA 1.478 0.972 0 N-CA-C 114.471 1.286 . . . . 0.0 114.471 -158.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.97 -31.1 3.75 Favored Glycine 0 C--N 1.338 0.665 0 CA-C-O 120.06 -0.3 . . . . 0.0 112.68 -164.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 28.5 mm-40 -111.17 78.85 1.15 Allowed 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 172.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 58.8 mttp -58.12 121.89 54.48 Favored Pre-proline 0 N--CA 1.478 0.957 0 CA-C-N 114.495 -1.23 . . . . 0.0 110.099 -174.627 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 44.0 Cg_endo -63.47 -86.28 0.01 OUTLIER 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 122.741 2.294 . . . . 0.0 111.981 -172.468 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 92.9 mt -145.55 100.65 3.47 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.529 -1.286 . . . . 0.0 107.529 179.256 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -142.18 126.95 18.11 Favored 'General case' 0 C--O 1.239 0.509 0 C-N-CA 123.371 0.668 . . . . 0.0 109.743 -176.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 26.4 t -64.67 109.4 2.01 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.872 1.269 . . . . 0.0 111.27 -179.243 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -87.6 49.26 1.77 Allowed 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 124.759 1.224 . . . . 0.0 110.085 -177.857 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 35.8 mm -133.9 -3.47 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.567 1.606 0 C-N-CA 125.528 1.531 . . . . 0.0 108.004 -178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.486 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.2 p 179.66 -133.44 0.0 OUTLIER 'General case' 0 N--CA 1.445 -0.689 0 N-CA-C 102.745 -3.058 . . . . 0.0 102.745 -165.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.486 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.68 129.55 3.24 Favored Glycine 0 C--N 1.306 -1.117 0 N-CA-C 107.438 -2.265 . . . . 0.0 107.438 161.118 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 32.6 t80 -176.79 113.29 0.1 Allowed 'General case' 0 C--N 1.354 0.803 0 N-CA-C 102.876 -3.009 . . . . 0.0 102.876 -170.281 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 7.3 m -115.55 140.68 48.94 Favored 'General case' 0 C--O 1.236 0.354 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 -168.0 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 63.0 m -133.01 161.58 33.99 Favored 'General case' 0 C--N 1.315 -0.931 0 C-N-CA 124.555 1.142 . . . . 0.0 110.875 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 99.2 mtt180 -97.24 -31.88 12.2 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.148 0.979 . . . . 0.0 109.462 171.976 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.3 mt-30 -97.28 130.71 44.44 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 124.152 0.981 . . . . 0.0 110.227 177.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 57.7 tttm -57.73 -44.03 85.7 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 124.57 1.148 . . . . 0.0 111.416 176.949 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.73 -40.56 69.39 Favored 'General case' 0 CA--C 1.554 1.108 0 CA-C-N 115.378 -0.828 . . . . 0.0 112.591 176.24 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 34.4 t -56.92 -55.43 34.6 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.738 0.815 . . . . 0.0 112.302 -175.328 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.474 ' H ' HD23 ' A' ' 57' ' ' LEU . 2.2 pt? -75.83 -27.94 58.07 Favored 'General case' 0 N--CA 1.479 1.012 0 CA-C-O 119.332 -0.366 . . . . 0.0 111.673 177.71 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.458 ' O ' ' HG3' ' A' ' 61' ' ' MET . 6.3 t30 -58.92 -39.82 82.7 Favored 'General case' 0 N--CA 1.492 1.636 0 C-N-CA 123.787 0.835 . . . . 0.0 112.744 175.268 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -79.69 -45.94 18.04 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.549 -0.908 . . . . 0.0 108.549 -179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.418 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 68.7 t60 -48.21 -37.73 16.61 Favored 'General case' 0 CA--C 1.569 1.676 0 N-CA-C 115.238 1.57 . . . . 0.0 115.238 168.03 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.458 ' HG3' ' O ' ' A' ' 58' ' ' ASN . 0.0 OUTLIER -72.09 -35.22 69.15 Favored 'General case' 0 N--CA 1.492 1.671 0 CA-C-N 119.647 1.112 . . . . 0.0 110.759 178.105 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 28.5 mtpp -62.45 -31.4 72.11 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.058 0.543 . . . . 0.0 111.277 170.67 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 3.8 mmmp? -58.54 -30.32 67.01 Favored 'General case' 0 N--CA 1.48 1.075 0 CA-C-N 115.945 -0.571 . . . . 0.0 111.933 173.535 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.456 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 96.8 m-70 -77.27 -10.73 59.61 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.064 0.546 . . . . 0.0 111.798 175.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -91.58 -33.74 15.01 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 122.602 0.361 . . . . 0.0 110.811 -171.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -110.79 3.9 19.44 Favored 'General case' 0 N--CA 1.475 0.803 0 C-N-CA 123.169 0.588 . . . . 0.0 110.484 178.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -44.24 81.37 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 126.916 2.086 . . . . 0.0 114.203 -171.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 26.1 m -79.37 -13.16 59.8 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 114.239 -1.346 . . . . 0.0 111.495 171.62 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -70.15 -35.06 73.77 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 122.682 0.393 . . . . 0.0 110.032 171.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 58.47 81.12 0.16 Allowed 'General case' 0 C--N 1.354 0.773 0 C-N-CA 124.783 1.233 . . . . 0.0 110.721 -178.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 43.4 tt0 -65.84 -43.13 89.42 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 124.617 1.167 . . . . 0.0 111.112 -175.47 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 31.8 m-85 -94.33 140.09 30.24 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 124.094 0.958 . . . . 0.0 108.638 -174.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 77.2 p -151.49 164.76 36.07 Favored 'General case' 0 C--N 1.332 -0.172 0 C-N-CA 123.921 0.888 . . . . 0.0 110.496 -177.87 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.735 ' H ' ' HA2' ' A' ' 78' ' ' GLY . 5.1 t -100.32 124.18 45.47 Favored 'General case' 0 C--N 1.327 -0.409 0 N-CA-C 106.976 -1.49 . . . . 0.0 106.976 170.256 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -70.56 -5.4 28.78 Favored 'General case' 0 N--CA 1.486 1.328 0 CA-C-N 118.246 0.475 . . . . 0.0 111.739 -179.753 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.8 mt -108.5 -32.13 2.44 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.789 0 C-N-CA 123.725 0.81 . . . . 0.0 109.15 -174.257 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.4 p -170.32 70.59 0.06 Allowed 'General case' 0 C--N 1.358 0.935 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 177.464 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . 0.735 ' HA2' ' H ' ' A' ' 74' ' ' CYS . . . -39.46 76.5 0.0 OUTLIER Glycine 0 N--CA 1.48 1.567 0 N-CA-C 117.672 1.829 . . . . 0.0 117.672 175.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 13.4 tmtt? -66.68 -21.87 66.09 Favored 'General case' 0 CA--C 1.549 0.92 0 C-N-CA 124.185 0.994 . . . . 0.0 111.264 171.226 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 43.5 mmtm 70.86 103.2 0.06 Allowed 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.987 1.315 . . . . 0.0 109.628 176.125 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.403 ' HB3' ' HB3' ' A' ' 86' ' ' SER . 70.2 m-85 -107.41 160.53 15.57 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.297 0.639 . . . . 0.0 111.55 -167.395 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -59.51 -38.66 81.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 124.361 1.065 . . . . 0.0 112.629 176.491 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 22.3 pttp -166.66 172.73 10.32 Favored 'General case' 0 C--N 1.35 0.616 0 O-C-N 123.831 0.707 . . . . 0.0 111.356 -179.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -55.6 -34.57 64.98 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 125.284 1.433 . . . . 0.0 112.578 -172.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 9.9 m-20 -54.86 -45.72 74.6 Favored 'General case' 0 N--CA 1.48 1.063 0 O-C-N 123.801 0.688 . . . . 0.0 111.182 179.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.403 ' HB3' ' HB3' ' A' ' 81' ' ' PHE . 26.3 t -69.81 -30.83 68.45 Favored 'General case' 0 CA--C 1.546 0.805 0 O-C-N 123.728 0.642 . . . . 0.0 111.107 -179.255 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 20.7 t -73.31 -44.61 54.77 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 CA-C-O 121.804 0.811 . . . . 0.0 109.98 -174.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.43 -38.07 67.16 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 CA-C-N 113.731 -1.577 . . . . 0.0 109.169 -177.773 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.19 -38.48 82.06 Favored 'General case' 0 C--N 1.353 0.735 0 CA-C-N 114.931 -1.031 . . . . 0.0 109.772 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 51.6 t60 -66.67 -49.69 65.34 Favored 'General case' 0 C--O 1.211 -0.93 0 CA-C-N 115.695 -0.684 . . . . 0.0 111.448 -178.423 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 5.7 ttpm? -70.82 -39.3 73.11 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.031 0.532 . . . . 0.0 110.113 -168.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -64.96 -23.91 67.36 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 115.389 -0.823 . . . . 0.0 112.081 179.866 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 96.5 mttt -99.23 -44.49 6.23 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 123.332 0.395 . . . . 0.0 111.425 -178.689 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 38.9 t -82.14 -26.73 33.25 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 124.457 1.103 . . . . 0.0 111.204 -173.219 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.5 m-70 -135.37 61.7 45.96 Favored Pre-proline 0 CA--C 1.558 1.254 0 C-N-CA 122.707 0.403 . . . . 0.0 111.49 -175.199 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.8 Cg_endo -75.37 -24.54 12.16 Favored 'Trans proline' 0 C--N 1.382 2.313 0 C-N-CA 121.272 1.315 . . . . 0.0 110.274 162.806 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -124.48 98.46 5.75 Favored 'General case' 0 N--CA 1.446 -0.641 0 C-N-CA 125.401 1.48 . . . . 0.0 107.371 171.38 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 1.7 p . . . . . 0 CA--C 1.549 0.917 0 C-N-CA 124.41 1.084 . . . . 0.0 109.387 175.038 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 37.4 m80 . . . . . 0 N--CA 1.483 1.212 0 N-CA-C 109.52 -0.548 . . . . 0.0 109.52 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.6 ttt -158.25 138.75 12.71 Favored 'General case' 0 C--O 1.238 0.497 0 C-N-CA 123.743 0.817 . . . . 0.0 109.678 -179.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptp180 -153.96 27.42 0.48 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.995 0.918 . . . . 0.0 109.194 174.448 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.453 ' HB2' ' HB1' ' A' ' 22' ' ' ALA . 6.6 p-10 -149.68 98.86 2.81 Favored 'General case' 0 CA--C 1.534 0.341 0 CA-C-N 114.399 -1.273 . . . . 0.0 109.035 -170.321 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 94.6 m-85 -76.97 119.74 21.12 Favored 'General case' 0 C--N 1.318 -0.776 0 CA-C-N 113.618 -1.628 . . . . 0.0 109.663 174.83 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.4 mm -105.03 149.18 8.64 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -174.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.777 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 1.4 t -83.6 163.39 20.39 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-O 121.611 0.72 . . . . 0.0 110.283 176.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.508 ' N ' ' SG ' ' A' ' 16' ' ' CYS . 31.5 tt0 -58.4 -32.76 68.93 Favored 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.523 -1.671 . . . . 0.0 111.217 -176.898 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.6 t80 -138.4 -49.52 0.55 Allowed 'General case' 0 C--N 1.352 0.682 0 C-N-CA 123.097 0.559 . . . . 0.0 109.978 -177.083 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 16.2 p -124.84 72.18 1.21 Allowed 'General case' 0 N--CA 1.478 0.942 0 CA-C-N 115.073 -0.967 . . . . 0.0 113.605 -169.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.777 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -141.65 135.09 29.59 Favored 'General case' 0 N--CA 1.486 1.367 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.983 150.495 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 16.4 ptm180 -69.19 -58.94 3.39 Favored 'General case' 0 CA--C 1.555 1.145 0 O-C-N 124.241 0.963 . . . . 0.0 109.483 168.575 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.453 ' HB1' ' HB2' ' A' ' 13' ' ' ASP . . . -172.99 133.4 0.54 Allowed 'General case' 0 C--N 1.364 1.23 0 C-N-CA 123.567 0.747 . . . . 0.0 111.083 170.483 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -114.35 130.75 56.69 Favored 'General case' 0 C--O 1.214 -0.791 0 N-CA-C 107.997 -1.112 . . . . 0.0 107.997 168.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 23.8 pttm -80.29 3.73 20.02 Favored 'General case' 0 N--CA 1.486 1.371 0 CA-C-N 118.44 0.564 . . . . 0.0 111.738 178.749 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . 0.429 ' HB3' ' ND2' ' A' ' 28' ' ' ASN . 16.7 t -137.4 134.88 36.42 Favored 'General case' 0 N--CA 1.472 0.655 0 C-N-CA 124.138 0.975 . . . . 0.0 109.827 178.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 17.4 p -69.14 -28.83 66.8 Favored 'General case' 0 N--CA 1.477 0.909 0 C-N-CA 123.832 0.853 . . . . 0.0 111.351 176.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.494 ' O ' HG23 ' A' ' 31' ' ' VAL . 67.9 t60 -62.97 -44.29 96.46 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.176 0.59 . . . . 0.0 110.252 176.213 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.469 ' ND2' HH12 ' A' ' 52' ' ' ARG . 3.3 m-80 -53.7 -51.28 63.78 Favored 'General case' 0 N--CA 1.493 1.705 0 C-N-CA 124.119 0.968 . . . . 0.0 111.464 177.529 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.8 tp -67.7 -34.86 77.72 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 113.812 -1.54 . . . . 0.0 111.287 -178.366 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -65.89 -43.43 88.26 Favored 'General case' 0 N--CA 1.49 1.563 0 C-N-CA 123.056 0.543 . . . . 0.0 111.004 176.51 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.664 ' HA ' ' HG3' ' A' ' 41' ' ' PRO . 61.8 t -65.17 -36.67 78.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.194 0 CA-C-N 115.391 -0.822 . . . . 0.0 110.553 175.681 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 50.2 t60 -65.28 -40.98 94.58 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 124.026 0.93 . . . . 0.0 110.75 174.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.472 ' HG2' ' HB2' ' A' ' 36' ' ' HIS . 17.2 ttt180 -75.08 9.74 1.83 Allowed 'General case' 0 CA--C 1.564 1.513 0 C-N-CA 123.907 0.883 . . . . 0.0 111.505 -174.441 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.538 ' HA ' ' O ' ' A' ' 39' ' ' GLU . 25.7 ptt? -49.68 -27.47 4.77 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 125.307 1.443 . . . . 0.0 113.705 169.037 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.412 HG22 ' H ' ' A' ' 35' ' ' ILE . 3.8 tp -86.82 -29.15 5.78 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.176 0 CA-C-N 114.671 -1.15 . . . . 0.0 110.225 -176.643 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.472 ' HB2' ' HG2' ' A' ' 33' ' ' ARG . 58.0 m-70 -99.9 -60.24 1.57 Allowed 'General case' 0 CA--C 1.559 1.312 0 N-CA-C 113.987 1.106 . . . . 0.0 113.987 -167.7 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.0 t -104.35 24.99 10.7 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 115.723 1.749 . . . . 0.0 115.723 -149.736 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 73.95 43.26 34.68 Favored Glycine 0 N--CA 1.478 1.497 0 C-N-CA 119.872 -1.156 . . . . 0.0 113.496 178.836 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.538 ' O ' ' HA ' ' A' ' 34' ' ' MET . 11.1 mm-40 -146.75 114.99 6.64 Favored 'General case' 0 C--O 1.217 -0.649 0 C-N-CA 124.592 1.157 . . . . 0.0 108.229 -166.264 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 49.6 mttp -112.4 94.0 25.2 Favored Pre-proline 0 N--CA 1.472 0.665 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 167.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.664 ' HG3' ' HA ' ' A' ' 31' ' ' VAL . 28.3 Cg_endo -58.32 -67.21 0.06 OUTLIER 'Trans proline' 0 C--N 1.374 1.897 0 C-N-CA 123.543 2.829 . . . . 0.0 112.188 -174.092 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.516 HD22 ' HB2' ' A' ' 54' ' ' LYS . 86.3 mt -146.23 90.88 2.0 Allowed 'General case' 0 N--CA 1.473 0.71 0 N-CA-C 106.741 -1.577 . . . . 0.0 106.741 176.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 53.2 tt0 -136.48 135.6 38.72 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.794 0.437 . . . . 0.0 111.904 -169.05 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.515 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 7.5 t -71.58 105.35 3.61 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 124.698 1.199 . . . . 0.0 109.725 171.435 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 31.2 tt0 -93.27 49.49 1.41 Allowed 'General case' 0 N--CA 1.475 0.824 0 CA-C-O 122.574 1.178 . . . . 0.0 110.185 176.765 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 3.1 mp -114.57 -55.31 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 105.492 -2.04 . . . . 0.0 105.492 169.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.544 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 21.3 p -112.7 -113.03 0.33 Allowed 'General case' 0 C--O 1.238 0.462 0 N-CA-C 103.997 -2.594 . . . . 0.0 103.997 175.598 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.544 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -148.32 154.63 25.98 Favored Glycine 0 C--N 1.313 -0.742 0 N-CA-C 108.626 -1.79 . . . . 0.0 108.626 152.972 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.515 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.9 t80 172.48 114.37 0.01 OUTLIER 'General case' 0 C--N 1.351 0.662 0 N-CA-C 105.206 -2.146 . . . . 0.0 105.206 -173.802 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 11.1 m -129.4 138.31 51.42 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 -177.365 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.418 ' SG ' ' N ' ' A' ' 52' ' ' ARG . 52.0 t -136.36 167.13 21.91 Favored 'General case' 0 C--N 1.312 -1.028 0 CA-C-N 114.599 -1.182 . . . . 0.0 111.131 -178.702 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.469 HH12 ' ND2' ' A' ' 28' ' ' ASN . 16.8 tpp85 -70.44 -33.82 71.75 Favored 'General case' 0 CA--C 1.541 0.619 0 CA-C-N 114.533 -1.212 . . . . 0.0 110.239 176.384 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.0 mm-40 -121.43 134.04 55.08 Favored 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 123.376 0.67 . . . . 0.0 109.918 178.813 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.516 ' HB2' HD22 ' A' ' 42' ' ' LEU . 5.5 ttpm? -59.29 -21.76 60.16 Favored 'General case' 0 N--CA 1.477 0.896 0 C-N-CA 123.495 0.718 . . . . 0.0 111.374 174.979 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -51.98 -28.13 15.74 Favored 'General case' 0 CA--C 1.558 1.252 0 C-N-CA 124.647 1.179 . . . . 0.0 112.582 176.545 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 25.5 m -77.52 -55.0 5.74 Favored 'General case' 0 CA--C 1.562 1.418 0 C-N-CA 123.27 0.628 . . . . 0.0 112.358 175.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.575 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.2 OUTLIER -75.86 -34.55 60.04 Favored 'General case' 0 N--CA 1.487 1.416 0 N-CA-C 113.386 0.884 . . . . 0.0 113.386 -171.85 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . 0.402 ' O ' ' HG2' ' A' ' 61' ' ' MET . 1.3 p-10 -55.51 -37.48 67.95 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 114.366 1.247 . . . . 0.0 114.366 -178.269 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.506 ' O ' ' HB3' ' A' ' 62' ' ' LYS . 45.8 p-90 -86.04 -35.85 20.07 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-N 118.251 0.478 . . . . 0.0 111.02 172.568 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.575 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 65.8 t60 -48.26 -32.23 6.98 Favored 'General case' 0 CA--C 1.572 1.822 0 N-CA-C 114.441 1.275 . . . . 0.0 114.441 171.152 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.449 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 23.8 ptp -69.48 -32.19 70.94 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 120.935 -1.103 . . . . 0.0 112.35 170.612 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.506 ' HB3' ' O ' ' A' ' 59' ' ' TRP . 39.3 ttmt -58.11 -29.17 65.28 Favored 'General case' 0 N--CA 1.498 1.968 0 C-N-CA 122.921 0.488 . . . . 0.0 111.457 169.507 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.414 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 31.2 mmmt -63.61 -38.09 89.8 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 122.916 0.486 . . . . 0.0 110.61 175.53 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.449 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 97.3 m-70 -71.61 -24.31 61.86 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.116 0.567 . . . . 0.0 110.281 177.335 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 22.1 t70 -84.15 -23.86 30.45 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 124.016 0.926 . . . . 0.0 109.057 179.568 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.18 -4.65 18.59 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 124.239 1.016 . . . . 0.0 111.529 -169.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -105.98 -18.02 14.17 Favored 'General case' 0 N--CA 1.479 0.981 0 N-CA-C 109.542 -0.54 . . . . 0.0 109.542 175.421 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.2 m -90.99 -69.01 0.76 Allowed 'General case' 0 CA--C 1.545 0.78 0 C-N-CA 122.686 0.395 . . . . 0.0 110.906 -176.513 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -136.99 -44.26 0.57 Allowed 'General case' 0 N--CA 1.492 1.668 0 N-CA-C 112.783 0.66 . . . . 0.0 112.783 -174.064 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 47.2 m-85 -89.47 65.52 7.09 Favored 'General case' 0 N--CA 1.481 1.113 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 -176.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 92.3 mt-30 -54.05 -55.6 25.95 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 125.302 1.441 . . . . 0.0 111.908 -169.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.428 ' O ' ' HA ' ' A' ' 80' ' ' LYS . 80.6 m-85 -139.98 137.83 35.02 Favored 'General case' 0 CA--C 1.523 -0.072 0 N-CA-C 107.627 -1.249 . . . . 0.0 107.627 178.662 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.0 m -120.28 138.67 53.55 Favored 'General case' 0 C--N 1.315 -0.923 0 C-N-CA 124.952 1.301 . . . . 0.0 109.339 -174.64 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 9.8 t -87.19 105.63 17.33 Favored 'General case' 0 C--O 1.213 -0.851 0 N-CA-C 106.051 -1.833 . . . . 0.0 106.051 169.831 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -58.74 -8.79 1.43 Allowed 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 113.176 0.806 . . . . 0.0 113.176 -173.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.515 HD11 HG13 ' A' ' 98' ' ' VAL . 8.4 mt -93.9 -48.05 13.3 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.241 0 C-N-CA 123.553 0.741 . . . . 0.0 112.156 178.089 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.438 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 15.9 p -132.06 5.39 4.17 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 113.411 0.893 . . . . 0.0 113.411 -172.891 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 55.35 34.83 59.79 Favored Glycine 0 C--N 1.341 0.829 0 C-N-CA 123.563 0.601 . . . . 0.0 114.366 176.714 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.438 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 8.1 tmtm? -65.21 -28.86 69.66 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.063 0.545 . . . . 0.0 111.712 -174.181 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.428 ' HA ' ' O ' ' A' ' 72' ' ' PHE . 75.4 mmtt 71.08 116.62 0.04 OUTLIER 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 124.658 1.183 . . . . 0.0 110.872 172.952 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.414 ' CZ ' ' HD2' ' A' ' 79' ' ' LYS . 89.5 m-85 -127.46 160.34 31.79 Favored 'General case' 0 N--CA 1.484 1.236 0 CA-C-O 121.041 0.448 . . . . 0.0 111.623 -179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 39.1 tt0 -64.47 -40.14 95.14 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 114.977 -1.01 . . . . 0.0 111.91 177.211 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -136.59 154.59 50.64 Favored 'General case' 0 C--O 1.242 0.691 0 C-N-CA 123.277 0.631 . . . . 0.0 109.981 -176.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -59.93 -31.19 69.62 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 114.292 -1.322 . . . . 0.0 111.347 177.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 3.2 m-20 -56.55 -45.16 81.39 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.62 0.768 . . . . 0.0 110.714 175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 49.5 m -67.87 -30.82 70.29 Favored 'General case' 0 CA--C 1.553 1.065 0 O-C-N 123.77 0.669 . . . . 0.0 111.776 179.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 48.1 t -74.29 -48.53 36.26 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.524 0 C-N-CA 123.431 0.692 . . . . 0.0 110.425 -176.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 84.0 t -73.68 -35.07 43.0 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.652 0 C-N-CA 124.944 1.298 . . . . 0.0 109.657 -174.003 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.56 -40.36 95.42 Favored 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.478 -0.783 . . . . 0.0 109.282 173.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 12.4 t60 -72.81 -34.74 67.07 Favored 'General case' 0 C--O 1.206 -1.2 0 CA-C-N 115.113 -0.949 . . . . 0.0 111.689 178.985 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -73.78 -36.81 65.1 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 123.316 0.647 . . . . 0.0 109.823 -176.368 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.38 -38.54 89.98 Favored 'General case' 0 CA--C 1.542 0.661 0 CA-C-N 114.78 -1.1 . . . . 0.0 111.033 175.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 30.1 mtpp -97.01 -46.85 6.03 Favored 'General case' 0 N--CA 1.481 1.081 0 N-CA-C 112.552 0.575 . . . . 0.0 112.552 -169.462 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.3 t -80.28 -20.74 43.73 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.633 0.773 . . . . 0.0 110.673 -173.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 19.3 m-70 -138.28 68.35 47.28 Favored Pre-proline 0 CA--C 1.561 1.399 0 C-N-CA 123.147 0.579 . . . . 0.0 109.532 -176.74 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_exo -44.21 -35.5 8.04 Favored 'Trans proline' 0 C--N 1.39 2.75 0 C-N-CA 123.685 2.924 . . . . 0.0 113.831 170.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 17.0 mm-40 -108.63 97.91 7.49 Favored 'General case' 0 N--CA 1.45 -0.449 0 N-CA-C 106.867 -1.531 . . . . 0.0 106.867 172.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.515 HG13 HD11 ' A' ' 76' ' ' ILE . 65.4 t . . . . . 0 C--O 1.255 1.344 0 CA-C-N 115.11 -0.95 . . . . 0.0 110.417 172.186 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 21.4 p-80 . . . . . 0 CA--C 1.545 0.768 0 CA-C-O 120.974 0.416 . . . . 0.0 110.356 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.47 ' HG3' ' HG2' ' A' ' 12' ' ' ARG . 20.0 ptp -168.37 -47.23 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 124.1 0.96 . . . . 0.0 109.638 173.68 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.47 ' HG2' ' HG3' ' A' ' 11' ' ' MET . 21.2 ptt180 -152.79 29.45 0.52 Allowed 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.157 0.983 . . . . 0.0 108.716 -179.952 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.5 p-10 -143.54 94.82 2.65 Favored 'General case' 0 CA--C 1.54 0.573 0 CA-C-O 122.746 1.26 . . . . 0.0 108.786 -166.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 51.6 m-85 -99.84 133.52 44.08 Favored 'General case' 0 C--O 1.24 0.579 0 CA-C-N 113.516 -1.675 . . . . 0.0 109.57 -174.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.703 HG22 ' H ' ' A' ' 17' ' ' GLU . 6.7 mm -115.18 149.49 17.38 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.521 0 C-N-CA 123.603 0.761 . . . . 0.0 109.582 -166.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.62 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.8 t -85.49 -20.39 29.79 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.531 0.732 . . . . 0.0 109.979 174.064 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.703 ' H ' HG22 ' A' ' 15' ' ' ILE . 36.7 tt0 85.95 -3.97 0.79 Allowed 'General case' 0 N--CA 1.497 1.904 0 C-N-CA 126.235 1.814 . . . . 0.0 111.19 171.095 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 11.1 t80 -135.87 -49.2 0.69 Allowed 'General case' 0 N--CA 1.474 0.736 0 N-CA-C 108.758 -0.83 . . . . 0.0 108.758 177.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -136.21 77.14 1.64 Allowed 'General case' 0 N--CA 1.471 0.612 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.357 -178.715 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.62 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -170.85 128.04 0.75 Allowed 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 124.605 1.162 . . . . 0.0 109.394 163.354 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.418 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 34.1 ptt180 -68.86 -58.25 4.42 Favored 'General case' 0 CA--C 1.546 0.793 0 N-CA-C 108.221 -1.029 . . . . 0.0 108.221 171.159 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.418 ' H ' ' HG3' ' A' ' 21' ' ' ARG . . . -173.2 152.85 2.34 Favored 'General case' 0 C--N 1.352 0.713 0 C-N-CA 124.135 0.974 . . . . 0.0 109.616 164.48 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 83.6 m-85 -125.94 152.05 46.15 Favored 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 124.558 1.143 . . . . 0.0 108.29 171.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -59.03 -30.31 67.93 Favored 'General case' 0 N--CA 1.482 1.13 0 N-CA-C 112.786 0.661 . . . . 0.0 112.786 -177.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 44.6 m -143.21 156.11 44.68 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.269 0.628 . . . . 0.0 110.98 -174.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.577 ' HA ' HD23 ' A' ' 29' ' ' LEU . 41.9 m -57.11 -36.52 70.73 Favored 'General case' 0 N--CA 1.483 1.213 0 CA-C-N 115.506 -0.77 . . . . 0.0 111.608 171.726 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 64.8 t60 -74.13 -35.41 64.1 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.087 0.555 . . . . 0.0 110.732 178.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.3 t-20 -59.78 -47.21 86.59 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.405 0.682 . . . . 0.0 110.467 174.31 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.577 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.2 OUTLIER -66.98 -28.99 68.71 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.828 0.851 . . . . 0.0 110.747 174.232 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.71 -27.52 69.27 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.345 0.658 . . . . 0.0 111.936 174.682 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 57.3 t -67.11 -41.45 87.07 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 122.749 0.42 . . . . 0.0 110.212 173.688 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.7 t60 -64.92 -38.45 91.01 Favored 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 123.703 0.801 . . . . 0.0 110.222 170.799 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.48 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 24.9 ttt85 -70.03 5.95 1.42 Allowed 'General case' 0 C--O 1.205 -1.242 0 C-N-CA 124.859 1.263 . . . . 0.0 111.723 -176.115 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.0 ptm -46.11 -18.4 0.05 Allowed 'General case' 0 N--CA 1.496 1.857 0 C-N-CA 125.314 1.446 . . . . 0.0 113.574 171.192 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.6 tp -85.98 -52.88 11.48 Favored 'Isoleucine or valine' 0 CA--C 1.575 1.919 0 C-N-CA 125.403 1.481 . . . . 0.0 110.428 174.424 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.48 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -100.42 6.45 44.42 Favored 'General case' 0 N--CA 1.513 2.676 0 C-N-CA 123.535 0.734 . . . . 0.0 112.65 -172.861 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.421 HG21 ' HA ' ' A' ' 40' ' ' LYS . 3.4 t -58.88 -55.4 35.58 Favored 'General case' 0 N--CA 1.489 1.518 0 N-CA-C 114.147 1.166 . . . . 0.0 114.147 -163.052 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.08 -31.41 3.13 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-O 120.083 -0.287 . . . . 0.0 112.62 -171.811 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 43.6 mt-10 -86.75 -48.54 8.16 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.883 0.873 . . . . 0.0 110.886 175.944 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . 0.421 ' HA ' HG21 ' A' ' 37' ' ' THR . 60.5 mttp 70.3 122.75 0.03 OUTLIER Pre-proline 0 N--CA 1.477 0.894 0 C-N-CA 126.107 1.763 . . . . 0.0 111.429 -168.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_exo -72.27 -170.84 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.217 0 C-N-CA 121.979 1.786 . . . . 0.0 110.679 164.388 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.445 HD13 ' HB3' ' A' ' 54' ' ' LYS . 95.4 mt -92.38 98.22 11.35 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 107.448 -1.316 . . . . 0.0 107.448 -178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 44.1 tt0 -122.46 130.15 52.77 Favored 'General case' 0 C--O 1.238 0.449 0 C-N-CA 124.389 1.076 . . . . 0.0 110.134 -167.013 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.463 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 21.1 t -69.0 107.05 2.98 Favored 'General case' 0 CA--C 1.541 0.603 0 CA-C-N 115.589 -0.732 . . . . 0.0 109.33 170.103 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -81.49 27.28 0.44 Allowed 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.581 1.152 . . . . 0.0 111.693 -178.323 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.463 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 21.8 mm -118.82 -3.31 9.96 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.293 0 C-N-CA 124.479 1.112 . . . . 0.0 108.773 -168.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 14.4 p 179.93 -122.43 0.0 OUTLIER 'General case' 0 C--N 1.348 0.523 0 N-CA-C 103.206 -2.887 . . . . 0.0 103.206 -169.029 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.26 135.47 5.24 Favored Glycine 0 C--N 1.309 -0.918 0 N-CA-C 107.142 -2.383 . . . . 0.0 107.142 158.356 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -179.36 111.86 0.05 Allowed 'General case' 0 C--N 1.346 0.431 0 N-CA-C 102.22 -3.252 . . . . 0.0 102.22 -174.985 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 8.2 m -128.71 146.52 50.86 Favored 'General case' 0 C--O 1.242 0.676 0 N-CA-C 108.968 -0.753 . . . . 0.0 108.968 -166.859 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 34.1 t -157.48 179.04 9.63 Favored 'General case' 0 C--N 1.317 -0.816 0 CA-C-N 114.796 -1.093 . . . . 0.0 109.595 -177.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 4.1 ptm180 -110.52 -3.43 16.01 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.409 0.684 . . . . 0.0 110.149 169.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -106.02 104.64 14.39 Favored 'General case' 0 N--CA 1.472 0.645 0 N-CA-C 107.25 -1.389 . . . . 0.0 107.25 172.44 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.445 ' HB3' HD13 ' A' ' 42' ' ' LEU . 51.5 pttt -57.64 -33.54 68.39 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 123.622 0.769 . . . . 0.0 112.801 -177.277 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.41 -41.73 69.63 Favored 'General case' 0 N--CA 1.484 1.264 0 C-N-CA 123.758 0.823 . . . . 0.0 112.097 175.796 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 39.3 m -52.08 -52.87 48.46 Favored 'General case' 0 N--CA 1.491 1.596 0 C-N-CA 124.088 0.955 . . . . 0.0 112.616 -178.627 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.466 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.3 OUTLIER -77.85 -31.49 51.51 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.607 0.763 . . . . 0.0 111.995 177.77 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -60.69 -44.0 97.06 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.575 0.75 . . . . 0.0 112.968 -178.178 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 27.3 p-90 -81.03 -36.84 30.04 Favored 'General case' 0 N--CA 1.483 1.208 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 -178.607 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 47.5 t60 -51.57 -30.72 21.88 Favored 'General case' 0 CA--C 1.564 1.51 0 C-N-CA 124.456 1.102 . . . . 0.0 113.683 165.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.435 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 28.5 ttt -71.6 -39.57 70.42 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 123.102 0.561 . . . . 0.0 111.357 173.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 36.4 ttmt -58.77 -34.43 71.42 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.273 0.629 . . . . 0.0 110.654 168.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -64.19 -29.42 70.53 Favored 'General case' 0 N--CA 1.476 0.827 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.628 173.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.435 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 82.7 m-70 -70.75 -11.6 61.05 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.882 -0.511 . . . . 0.0 111.794 172.815 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 25.7 t70 -102.42 -17.85 15.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 124.013 0.925 . . . . 0.0 108.586 177.931 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -97.65 -44.51 6.75 Favored 'General case' 0 C--N 1.351 0.658 0 C-N-CA 123.954 0.902 . . . . 0.0 110.645 -171.857 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.651 ' HA ' ' HG2' ' A' ' 71' ' ' GLN . 8.1 m-20 -74.05 1.56 10.76 Favored 'General case' 0 N--CA 1.487 1.376 0 N-CA-C 112.684 0.624 . . . . 0.0 112.684 -167.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 21.9 t -79.9 -64.24 1.23 Allowed 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.513 0.725 . . . . 0.0 109.867 -179.947 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 83.0 m-85 -136.78 -29.31 0.94 Allowed 'General case' 0 N--CA 1.493 1.677 0 C-N-CA 123.696 0.799 . . . . 0.0 111.868 -178.021 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 51.3 m-85 -115.79 68.64 0.72 Allowed 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.116 0.566 . . . . 0.0 109.829 -170.493 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.651 ' HG2' ' HA ' ' A' ' 67' ' ' ASP . 44.1 mt-30 -76.6 -10.35 59.32 Favored 'General case' 0 N--CA 1.481 1.095 0 CA-C-N 115.526 -0.761 . . . . 0.0 112.185 -172.014 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 63.1 m-85 -118.11 156.59 28.4 Favored 'General case' 0 C--O 1.242 0.665 0 N-CA-C 108.19 -1.041 . . . . 0.0 108.19 176.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 58.1 p -157.58 123.82 4.82 Favored 'General case' 0 C--N 1.322 -0.598 0 C-N-CA 124.467 1.107 . . . . 0.0 108.562 -176.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 42.9 t -70.69 114.03 8.37 Favored 'General case' 0 C--O 1.224 -0.28 0 N-CA-C 106.777 -1.564 . . . . 0.0 106.777 169.008 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 3.0 m-20 -60.12 -13.89 14.24 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.947 0.721 . . . . 0.0 112.947 -172.918 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.7 mt -104.38 -31.41 2.79 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.354 0 N-CA-C 112.75 0.648 . . . . 0.0 112.75 -175.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.541 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 19.4 p -136.2 -4.95 2.11 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 120.765 -1.209 . . . . 0.0 113.389 -178.001 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.05 33.75 85.26 Favored Glycine 0 C--N 1.347 1.185 0 C-N-CA 123.039 0.352 . . . . 0.0 113.381 176.157 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.541 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.0 tmtt? -65.76 -35.13 79.85 Favored 'General case' 0 CA--C 1.559 1.294 0 C-N-CA 124.03 0.932 . . . . 0.0 112.103 -176.343 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? 73.67 120.09 0.04 OUTLIER 'General case' 0 N--CA 1.491 1.62 0 C-N-CA 124.816 1.246 . . . . 0.0 110.4 -176.625 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 83.9 m-85 -128.56 162.42 27.29 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.913 0.885 . . . . 0.0 109.861 175.203 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.498 ' HB2' ' HD3' ' A' ' 83' ' ' LYS . 8.1 mm-40 -70.69 -28.3 64.66 Favored 'General case' 0 CA--C 1.543 0.673 0 C-N-CA 123.437 0.695 . . . . 0.0 112.673 -178.868 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.498 ' HD3' ' HB2' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -144.39 151.22 38.96 Favored 'General case' 0 C--O 1.235 0.339 0 N-CA-C 109.031 -0.729 . . . . 0.0 109.031 178.122 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 49.4 mtmt -66.2 -25.1 66.77 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 115.245 -0.889 . . . . 0.0 112.632 -177.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 1.4 p30 -69.65 -28.29 65.76 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 109.516 -0.549 . . . . 0.0 109.516 175.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.425 ' O ' ' HB3' ' A' ' 90' ' ' HIS . 49.4 m -67.48 -31.7 72.03 Favored 'General case' 0 C--N 1.359 1.012 0 O-C-N 122.952 0.157 . . . . 0.0 110.923 171.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 98.4 t -75.15 -47.69 34.93 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 C-N-CA 124.002 0.921 . . . . 0.0 110.196 -178.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 70.6 t -73.34 -35.94 47.68 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.867 0 C-N-CA 125.081 1.352 . . . . 0.0 109.959 -174.36 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.85 -41.89 95.33 Favored 'General case' 0 N--CA 1.479 0.983 0 N-CA-C 108.996 -0.742 . . . . 0.0 108.996 173.951 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . 0.425 ' HB3' ' O ' ' A' ' 86' ' ' SER . 2.3 t60 -71.41 -30.18 65.79 Favored 'General case' 0 N--CA 1.477 0.893 0 CA-C-N 114.942 -1.027 . . . . 0.0 110.873 178.819 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -71.6 -41.0 69.47 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.412 1.085 . . . . 0.0 109.603 -176.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.71 -19.36 64.36 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 114.554 -1.203 . . . . 0.0 112.125 179.038 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 8.1 mtpm? -105.58 -42.03 5.31 Favored 'General case' 0 N--CA 1.484 1.261 0 C-N-CA 123.219 0.608 . . . . 0.0 112.34 -176.05 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 36.8 t -93.26 -23.08 18.64 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.096 0.958 . . . . 0.0 111.306 -172.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.435 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 53.7 m-70 -131.86 43.49 1.11 Allowed Pre-proline 0 CA--C 1.57 1.732 0 N-CA-C 113.016 0.747 . . . . 0.0 113.016 -174.057 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.435 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 37.7 Cg_exo -60.95 -34.48 90.86 Favored 'Trans proline' 0 C--N 1.395 2.975 0 CA-C-N 122.083 1.78 . . . . 0.0 112.087 171.854 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.2 mm-40 -113.83 97.6 6.5 Favored 'General case' 0 C--N 1.349 0.577 0 C-N-CA 124.606 1.162 . . . . 0.0 108.691 178.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 61.1 t . . . . . 0 C--O 1.256 1.413 0 C-N-CA 124.313 1.045 . . . . 0.0 109.207 173.654 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 94.9 m-70 . . . . . 0 N--CA 1.478 0.971 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 46.1 ttm -155.35 -66.55 0.12 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 122.841 0.456 . . . . 0.0 110.527 -177.628 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 59.4 ttt-85 -107.21 32.24 4.78 Favored 'General case' 0 N--CA 1.489 1.484 0 CA-C-O 122.563 1.173 . . . . 0.0 108.542 -178.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 -164.71 114.24 1.13 Allowed 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 106.841 -1.54 . . . . 0.0 106.841 -168.374 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 65.7 m-85 -121.54 120.62 35.38 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 123.792 0.837 . . . . 0.0 110.715 -178.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 43.0 mm -100.95 110.11 27.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.382 0 CA-C-N 115.263 -0.88 . . . . 0.0 109.097 -177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 7.7 t -61.97 90.82 0.03 OUTLIER 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 107.235 -1.394 . . . . 0.0 107.235 158.473 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 18.47 -59.44 0.0 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 C-N-CA 129.101 2.96 . . . . 0.0 116.563 174.079 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 3.5 t80 -121.35 -39.28 2.69 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.965 -0.562 . . . . 0.0 111.474 -165.046 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -92.25 -23.36 19.35 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 113.242 0.83 . . . . 0.0 113.242 -168.77 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -89.32 125.88 35.3 Favored 'General case' 0 N--CA 1.475 0.813 0 N-CA-C 113.326 0.861 . . . . 0.0 113.326 -170.829 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.432 ' CD ' ' H ' ' A' ' 21' ' ' ARG . 0.1 OUTLIER -69.62 -52.01 29.77 Favored 'General case' 0 CA--C 1.561 1.382 0 CA-C-N 114.306 -1.315 . . . . 0.0 109.029 163.374 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -177.43 138.17 0.22 Allowed 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 125.24 1.416 . . . . 0.0 108.568 160.555 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -105.02 151.81 23.5 Favored 'General case' 0 N--CA 1.473 0.705 0 N-CA-C 109.062 -0.718 . . . . 0.0 109.062 171.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 53.1 mtpt -63.29 -34.71 78.27 Favored 'General case' 0 CA--C 1.54 0.591 0 CA-C-N 115.384 -0.825 . . . . 0.0 111.309 177.068 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 m -146.95 154.44 41.27 Favored 'General case' 0 CA--C 1.553 1.064 0 CA-C-O 121.124 0.488 . . . . 0.0 111.817 -169.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 43.2 p -61.03 -45.31 95.3 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 124.72 1.208 . . . . 0.0 112.142 176.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 30.2 m-70 -68.78 -35.63 77.29 Favored 'General case' 0 N--CA 1.48 1.031 0 CA-C-N 116.072 -0.513 . . . . 0.0 111.037 178.438 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -56.26 -51.69 67.2 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.505 0.722 . . . . 0.0 111.106 177.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -62.68 -37.11 85.12 Favored 'General case' 0 N--CA 1.481 1.121 0 CA-C-N 115.079 -0.964 . . . . 0.0 110.984 176.85 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.06 -29.23 68.41 Favored 'General case' 0 N--CA 1.484 1.259 0 O-C-N 124.137 0.898 . . . . 0.0 112.532 -177.642 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.5 t -64.99 -45.21 95.32 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.216 0 C-N-CA 123.219 0.608 . . . . 0.0 110.972 175.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -71.55 -35.83 70.75 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 123.333 0.653 . . . . 0.0 109.479 177.241 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.644 ' HG2' ' HA ' ' A' ' 37' ' ' THR . 39.1 ttt85 -61.96 -8.08 4.68 Favored 'General case' 0 CA--C 1.548 0.896 0 C-N-CA 125.348 1.459 . . . . 0.0 112.361 -175.827 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.41 ' HA ' ' HB ' ' A' ' 37' ' ' THR . 23.0 ptm -46.04 -12.55 0.02 OUTLIER 'General case' 0 N--CA 1.51 2.544 0 N-CA-C 116.534 2.05 . . . . 0.0 116.534 -178.159 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -84.09 -53.42 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.73 0 C-N-CA 124.587 1.155 . . . . 0.0 108.641 172.846 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.548 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.2 OUTLIER -101.82 14.37 32.14 Favored 'General case' 0 N--CA 1.494 1.754 0 C-N-CA 125.399 1.479 . . . . 0.0 112.435 -176.161 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.644 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 13.5 t -57.89 -70.47 0.13 Allowed 'General case' 0 CA--C 1.559 1.322 0 N-CA-C 116.523 2.046 . . . . 0.0 116.523 -154.284 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 61.03 32.86 81.8 Favored Glycine 0 N--CA 1.479 1.541 0 CA-C-N 118.994 0.815 . . . . 0.0 111.099 -169.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.446 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 10.6 mm-40 -147.5 -42.31 0.17 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 126.517 1.927 . . . . 0.0 106.913 -172.777 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 3.6 mppt? 61.5 96.67 0.04 OUTLIER Pre-proline 0 C--N 1.356 0.878 0 C-N-CA 126.067 1.747 . . . . 0.0 112.245 174.019 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 91.6 Cg_endo -76.07 -173.23 1.6 Allowed 'Trans proline' 0 C--N 1.374 1.871 0 C-N-CA 122.4 2.067 . . . . 0.0 110.185 161.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -120.3 118.47 30.49 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 122.802 0.441 . . . . 0.0 110.064 -175.519 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -116.06 148.78 39.85 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.577 0.751 . . . . 0.0 109.664 -179.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.464 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.8 t -66.37 107.74 2.12 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 123.475 0.71 . . . . 0.0 109.962 167.285 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -75.91 8.71 2.89 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 123.646 0.779 . . . . 0.0 112.893 -178.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.464 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 39.2 mm -88.77 -56.24 5.44 Favored 'Isoleucine or valine' 0 C--N 1.353 0.745 0 N-CA-C 107.753 -1.202 . . . . 0.0 107.753 176.653 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.505 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.3 p -119.44 -107.76 0.37 Allowed 'General case' 0 N--CA 1.443 -0.783 0 N-CA-C 104.139 -2.541 . . . . 0.0 104.139 175.155 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.505 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.16 164.18 29.24 Favored Glycine 0 CA--C 1.522 0.493 0 N-CA-C 108.916 -1.674 . . . . 0.0 108.916 160.097 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.0 t80 167.47 112.61 0.01 OUTLIER 'General case' 0 C--N 1.353 0.725 0 N-CA-C 103.379 -2.822 . . . . 0.0 103.379 178.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 1.8 m -117.1 135.31 53.84 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 121.577 0.703 . . . . 0.0 109.765 -165.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.4 t -151.89 164.4 37.2 Favored 'General case' 0 C--N 1.315 -0.916 0 CA-C-N 114.426 -1.261 . . . . 0.0 109.837 -177.715 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 28.7 ttm180 -81.57 -31.14 32.74 Favored 'General case' 0 CA--C 1.544 0.72 0 CA-C-N 115.281 -0.872 . . . . 0.0 110.069 176.128 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 78.3 mt-30 -103.99 127.18 51.54 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 124.372 1.069 . . . . 0.0 109.487 -173.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.9 ptmt -55.86 -30.21 61.14 Favored 'General case' 0 N--CA 1.479 1.004 0 O-C-N 123.723 0.639 . . . . 0.0 112.029 175.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.61 -42.52 83.44 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 124.397 1.079 . . . . 0.0 112.901 -177.777 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 28.0 t -59.97 -54.36 46.94 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.343 0.657 . . . . 0.0 111.674 -177.051 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.5 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.5 OUTLIER -75.43 -24.11 57.03 Favored 'General case' 0 C--O 1.211 -0.944 0 C-N-CA 123.744 0.818 . . . . 0.0 112.013 177.605 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 9.3 t30 -52.0 -42.98 63.43 Favored 'General case' 0 N--CA 1.495 1.815 0 C-N-CA 123.553 0.741 . . . . 0.0 112.751 175.168 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 83.2 m95 -79.67 -48.37 13.81 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.932 -0.766 . . . . 0.0 108.932 178.986 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.486 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 83.2 t60 -48.52 -39.98 25.2 Favored 'General case' 0 CA--C 1.569 1.694 0 N-CA-C 114.584 1.327 . . . . 0.0 114.584 174.157 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.418 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 0.0 OUTLIER -71.01 -37.53 72.63 Favored 'General case' 0 N--CA 1.49 1.56 0 CA-C-N 119.991 1.268 . . . . 0.0 110.551 175.861 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 20.4 ttpp -65.24 -26.35 68.07 Favored 'General case' 0 CA--C 1.554 1.133 0 C-N-CA 123.532 0.733 . . . . 0.0 111.496 174.999 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.35 -35.54 79.44 Favored 'General case' 0 N--CA 1.483 1.223 0 N-CA-C 109.225 -0.657 . . . . 0.0 109.225 173.958 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.418 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 94.6 m-70 -68.37 -16.98 64.12 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.136 0.574 . . . . 0.0 111.659 178.133 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.3 t70 -81.19 -25.17 36.97 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.278 0.631 . . . . 0.0 109.648 179.215 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -108.37 -33.46 7.08 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.738 0.815 . . . . 0.0 111.716 -170.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -67.45 -22.11 65.51 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 113.119 0.785 . . . . 0.0 113.119 -158.092 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 m -66.96 -53.5 31.01 Favored 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 123.825 0.85 . . . . 0.0 111.765 -173.607 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -135.95 -44.39 0.65 Allowed 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.084 0.553 . . . . 0.0 110.377 -177.822 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 27.1 m-85 -98.59 58.33 1.21 Allowed 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.658 0.783 . . . . 0.0 109.503 -172.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -61.43 -14.34 27.55 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 124.153 0.981 . . . . 0.0 111.759 -168.854 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 97.2 m-85 -134.85 141.06 46.28 Favored 'General case' 0 C--N 1.35 0.591 0 C-N-CA 125.045 1.338 . . . . 0.0 107.922 175.037 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.544 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 68.8 p -128.65 168.97 15.02 Favored 'General case' 0 C--N 1.323 -0.577 0 C-N-CA 124.9 1.28 . . . . 0.0 109.892 -176.392 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 37.2 t -123.6 97.31 5.32 Favored 'General case' 0 C--O 1.2 -1.534 0 N-CA-C 107.256 -1.387 . . . . 0.0 107.256 176.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 66.2 t30 -56.72 -14.83 3.64 Favored 'General case' 0 N--CA 1.498 1.944 0 N-CA-C 114.109 1.152 . . . . 0.0 114.109 -169.245 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 1.3 mt -87.35 -22.87 6.76 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.037 0 C-N-CA 122.749 0.419 . . . . 0.0 111.474 -176.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.642 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.4 p -147.56 4.14 0.77 Allowed 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 113.385 0.883 . . . . 0.0 113.385 179.252 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 53.09 37.02 53.45 Favored Glycine 0 C--N 1.353 1.481 0 C-N-CA 124.161 0.886 . . . . 0.0 114.72 -177.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.642 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 7.1 tmtt? -66.3 -37.91 86.5 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.221 0.609 . . . . 0.0 111.646 -172.228 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.544 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 71.5 mmtt 72.25 117.02 0.05 OUTLIER 'General case' 0 C--N 1.362 1.15 0 C-N-CA 124.797 1.239 . . . . 0.0 110.11 176.751 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.413 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.6 m-85 -125.31 164.99 19.17 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 179.693 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -63.57 -39.51 94.57 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 114.408 -1.269 . . . . 0.0 111.54 176.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -145.8 155.83 43.18 Favored 'General case' 0 C--O 1.24 0.555 0 C-N-CA 123.021 0.528 . . . . 0.0 110.023 -177.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.9 pptp? -64.34 -24.42 67.64 Favored 'General case' 0 N--CA 1.477 0.908 0 CA-C-N 115.781 -0.645 . . . . 0.0 112.102 -178.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -56.52 -47.1 80.07 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 123.062 0.545 . . . . 0.0 110.484 170.948 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 20.1 m -65.81 -30.77 71.45 Favored 'General case' 0 CA--C 1.554 1.112 0 CA-C-N 115.793 -0.639 . . . . 0.0 111.423 179.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 86.5 t -72.92 -49.26 40.75 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.26 0 C-N-CA 123.714 0.805 . . . . 0.0 110.194 -176.837 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 73.7 t -71.78 -35.37 54.91 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.853 0 C-N-CA 124.963 1.305 . . . . 0.0 109.182 -174.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -63.52 -44.41 94.32 Favored 'General case' 0 C--N 1.346 0.456 0 CA-C-N 114.716 -1.129 . . . . 0.0 109.517 175.204 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 2.1 t60 -73.05 -35.0 66.62 Favored 'General case' 0 N--CA 1.48 1.032 0 CA-C-N 115.181 -0.918 . . . . 0.0 111.42 -178.407 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -69.83 -38.81 76.65 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.277 1.031 . . . . 0.0 109.244 -172.021 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.24 -23.07 66.35 Favored 'General case' 0 CA--C 1.547 0.837 0 CA-C-N 114.641 -1.163 . . . . 0.0 111.459 178.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 62.2 mttm -91.94 -50.82 5.51 Favored 'General case' 0 N--CA 1.483 1.181 0 CA-C-O 121.197 0.522 . . . . 0.0 110.423 -178.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 44.7 t -85.12 -23.92 28.24 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.825 1.25 . . . . 0.0 111.795 -169.14 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 40.7 m-70 -132.34 59.52 44.41 Favored Pre-proline 0 CA--C 1.562 1.439 0 C-N-CA 122.557 0.343 . . . . 0.0 111.715 -172.779 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 61.6 Cg_endo -72.1 -31.71 11.79 Favored 'Trans proline' 0 C--N 1.384 2.398 0 C-N-CA 121.855 1.704 . . . . 0.0 111.045 170.167 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 19.0 mm-40 -128.95 98.14 4.85 Favored 'General case' 0 C--N 1.346 0.442 0 C-N-CA 124.965 1.306 . . . . 0.0 107.836 176.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 89.2 t . . . . . 0 C--O 1.249 1.05 0 CA-C-N 114.656 -1.156 . . . . 0.0 110.298 178.514 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 18.2 t-160 . . . . . 0 N--CA 1.483 1.175 0 N-CA-C 109.217 -0.66 . . . . 0.0 109.217 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -91.93 23.88 3.48 Favored 'General case' 0 N--CA 1.485 1.277 0 C-N-CA 123.716 0.807 . . . . 0.0 112.48 -170.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 42.0 ttm180 -143.85 131.99 21.81 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 124.135 0.974 . . . . 0.0 108.377 178.638 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 59.85 95.39 0.03 OUTLIER 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 125.117 1.367 . . . . 0.0 111.707 -177.646 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -97.27 113.11 24.69 Favored 'General case' 0 N--CA 1.48 1.031 0 C-N-CA 124.27 1.028 . . . . 0.0 109.744 -177.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 3.4 mm -105.54 157.05 6.32 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.869 0 C-N-CA 123.22 0.608 . . . . 0.0 109.576 -167.334 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.622 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 23.4 t -90.85 12.21 20.12 Favored 'General case' 0 N--CA 1.484 1.254 0 C-N-CA 122.679 0.391 . . . . 0.0 111.205 173.396 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 87.54 -38.88 0.03 OUTLIER 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 125.761 1.624 . . . . 0.0 110.08 170.748 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.1 t80 -137.41 -55.26 0.69 Allowed 'General case' 0 C--N 1.351 0.664 0 C-N-CA 122.73 0.412 . . . . 0.0 110.028 175.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 2.0 p -94.82 58.86 2.31 Favored 'General case' 0 N--CA 1.488 1.425 0 N-CA-C 112.779 0.659 . . . . 0.0 112.779 -176.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.622 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.14 142.24 4.94 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.003 0.921 . . . . 0.0 110.46 160.724 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.419 ' HG3' ' N ' ' A' ' 22' ' ' ALA . 10.2 ptp180 -68.0 -58.55 4.34 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-O 118.982 -0.532 . . . . 0.0 109.621 167.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.419 ' N ' ' HG3' ' A' ' 21' ' ' ARG . . . 174.28 134.87 0.04 OUTLIER 'General case' 0 C--N 1.358 0.961 0 C-N-CA 125.738 1.615 . . . . 0.0 108.0 178.546 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 90.4 m-85 -108.46 164.52 12.27 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 108.771 -0.826 . . . . 0.0 108.771 170.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -56.4 -44.53 80.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 124.934 1.294 . . . . 0.0 111.339 -177.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 66.0 m -146.21 168.59 20.65 Favored 'General case' 0 N--CA 1.472 0.656 0 CA-C-N 115.136 -0.938 . . . . 0.0 110.301 -177.728 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.528 ' HA ' HD23 ' A' ' 29' ' ' LEU . 51.0 p -64.62 -39.24 93.37 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.275 1.03 . . . . 0.0 112.617 -176.967 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 70.4 m-70 -75.13 -37.0 61.57 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.395 0.678 . . . . 0.0 110.909 179.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -55.49 -41.93 73.71 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.911 0.885 . . . . 0.0 110.581 167.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.528 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -72.8 -33.81 66.48 Favored 'General case' 0 C--O 1.218 -0.581 0 CA-C-N 114.259 -1.337 . . . . 0.0 110.899 178.236 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.628 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -62.75 -28.23 69.83 Favored 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.336 1.055 . . . . 0.0 111.9 -179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 60.2 t -50.29 -46.65 25.68 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 123.834 0.709 . . . . 0.0 111.49 168.593 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.4 t60 -77.06 -45.66 26.34 Favored 'General case' 0 N--CA 1.482 1.155 0 CA-C-N 115.858 -0.61 . . . . 0.0 110.349 171.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.628 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 56.8 ttt180 -79.04 40.21 0.4 Allowed 'General case' 0 CA--C 1.547 0.864 0 C-N-CA 125.289 1.435 . . . . 0.0 110.155 -170.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 24.5 ptt? -60.7 -52.77 63.69 Favored 'General case' 0 C--N 1.357 0.905 0 C-N-CA 123.824 0.85 . . . . 0.0 112.405 -162.155 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 11.2 tp -85.16 -17.89 9.5 Favored 'Isoleucine or valine' 0 CA--C 1.563 1.449 0 N-CA-C 116.17 1.915 . . . . 0.0 116.17 174.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.581 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 49.3 m-70 -84.33 -42.3 15.91 Favored 'General case' 0 N--CA 1.5 2.06 0 CA-C-N 120.613 1.552 . . . . 0.0 109.734 -156.7 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.3 t -70.9 -27.36 63.74 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 114.768 -1.106 . . . . 0.0 113.405 -165.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.58 33.88 12.69 Favored Glycine 0 C--N 1.342 0.874 0 CA-C-N 116.288 -0.415 . . . . 0.0 112.183 -178.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 45.5 mt-10 -110.83 -30.56 7.5 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.285 1.034 . . . . 0.0 109.98 179.19 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 59.9 pttt 44.55 72.84 1.09 Allowed Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 126.323 1.849 . . . . 0.0 112.572 -171.268 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 33.7 Cg_endo -62.72 147.41 94.75 Favored 'Trans proline' 0 C--N 1.381 2.239 0 C-N-CA 122.508 2.139 . . . . 0.0 111.581 175.41 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.474 ' O ' ' HA ' ' A' ' 50' ' ' THR . 91.2 mt -80.64 137.12 36.32 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 108.812 -0.81 . . . . 0.0 108.812 -171.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.456 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 61.7 tt0 -117.65 139.3 51.2 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 110.101 -0.333 . . . . 0.0 110.101 -168.254 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.715 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 1.8 t -64.28 112.79 3.22 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.936 0.894 . . . . 0.0 110.79 173.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -82.02 26.63 0.51 Allowed 'General case' 0 CA--C 1.555 1.143 0 C-N-CA 123.689 0.796 . . . . 0.0 112.773 -178.214 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.403 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 25.7 mm -105.64 -53.17 7.02 Favored 'Isoleucine or valine' 0 C--N 1.352 0.676 0 N-CA-C 107.658 -1.238 . . . . 0.0 107.658 169.34 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.542 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 27.3 p -118.5 -109.33 0.36 Allowed 'General case' 0 C--N 1.346 0.443 0 N-CA-C 104.512 -2.403 . . . . 0.0 104.512 173.864 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.542 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.02 165.92 29.35 Favored Glycine 0 CA--C 1.523 0.549 0 N-CA-C 108.624 -1.79 . . . . 0.0 108.624 155.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.688 ' HB2' ' HG3' ' A' ' 82' ' ' GLU . 23.8 t80 175.61 111.7 0.02 OUTLIER 'General case' 0 CA--C 1.513 -0.46 0 N-CA-C 104.298 -2.482 . . . . 0.0 104.298 177.309 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.474 ' HA ' ' O ' ' A' ' 42' ' ' LEU . 0.6 OUTLIER -105.64 125.58 51.15 Favored 'General case' 0 N--CA 1.448 -0.527 0 N-CA-C 108.919 -0.771 . . . . 0.0 108.919 -171.996 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 53.5 t -143.13 165.8 26.42 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.343 0.657 . . . . 0.0 111.622 -177.144 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 57.1 ttt180 -70.18 -42.72 72.04 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 124.903 1.281 . . . . 0.0 110.835 -179.66 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 9.9 pt20 -110.98 131.37 55.1 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.548 0.739 . . . . 0.0 110.525 -179.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 65.1 tttp -50.86 -37.26 42.24 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.793 1.237 . . . . 0.0 111.447 172.721 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -52.08 -36.95 52.37 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.254 1.022 . . . . 0.0 112.515 -176.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 53.8 m -69.47 -55.97 8.74 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.451 0.301 . . . . 0.0 111.569 179.534 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -76.57 -41.82 45.03 Favored 'General case' 0 N--CA 1.479 0.982 0 N-CA-C 113.353 0.871 . . . . 0.0 113.353 -173.126 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 41.1 t30 -50.25 -54.18 22.99 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.769 0.827 . . . . 0.0 111.77 178.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.536 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 58.6 m95 -78.27 -33.92 49.28 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 115.638 -0.71 . . . . 0.0 109.331 -172.848 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -45.1 -41.17 7.58 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 124.049 0.843 . . . . 0.0 112.617 163.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.715 ' HG2' ' SG ' ' A' ' 44' ' ' CYS . 33.6 mtm -61.85 -48.01 82.49 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 117.465 0.121 . . . . 0.0 110.892 178.138 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 4.2 mptp? -57.79 -39.54 77.77 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 124.102 0.876 . . . . 0.0 111.014 176.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.536 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 31.4 mmmt -59.42 -45.73 90.71 Favored 'General case' 0 N--CA 1.48 1.062 0 O-C-N 124.208 0.943 . . . . 0.0 110.221 179.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -108.06 9.61 28.36 Favored 'General case' 0 N--CA 1.483 1.197 0 N-CA-C 112.931 0.715 . . . . 0.0 112.931 -172.226 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -55.8 -33.49 64.45 Favored 'General case' 0 N--CA 1.491 1.623 0 C-N-CA 123.3 0.64 . . . . 0.0 111.118 171.83 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.65 -32.09 11.25 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 115.681 -0.69 . . . . 0.0 110.797 170.885 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.0 m-20 73.25 18.29 3.8 Favored 'General case' 0 N--CA 1.498 1.932 0 C-N-CA 125.579 1.552 . . . . 0.0 110.303 -174.704 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 22.7 t -59.95 -26.88 66.34 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.573 0.749 . . . . 0.0 111.717 -170.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.511 ' HB3' ' HG2' ' A' ' 71' ' ' GLN . 97.4 m-85 -69.55 -46.63 65.97 Favored 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 123.441 0.696 . . . . 0.0 111.819 -179.335 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 53.9 m-85 45.04 35.77 1.73 Allowed 'General case' 0 N--CA 1.496 1.859 0 C-N-CA 123.998 0.919 . . . . 0.0 112.383 -172.295 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.511 ' HG2' ' HB3' ' A' ' 69' ' ' PHE . 25.7 mm-40 -84.74 -5.51 59.32 Favored 'General case' 0 N--CA 1.485 1.283 0 N-CA-C 112.74 0.645 . . . . 0.0 112.74 -167.489 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 58.0 m-85 -140.31 132.57 28.22 Favored 'General case' 0 C--N 1.35 0.601 0 N-CA-C 106.488 -1.671 . . . . 0.0 106.488 -177.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.65 ' HA ' ' HA ' ' A' ' 80' ' ' LYS . 32.6 p -156.94 165.89 34.9 Favored 'General case' 0 C--N 1.312 -1.053 0 C-N-CA 125.154 1.382 . . . . 0.0 109.215 175.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 43.0 t -86.91 124.29 32.95 Favored 'General case' 0 C--N 1.324 -0.503 0 N-CA-C 107.917 -1.142 . . . . 0.0 107.917 175.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -62.68 -25.86 68.36 Favored 'General case' 0 N--CA 1.483 1.185 0 C-N-CA 122.678 0.391 . . . . 0.0 110.987 178.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.6 mt -92.44 -42.99 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.28 0 C-N-CA 123.013 0.525 . . . . 0.0 112.221 -172.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.4 p -137.14 8.4 2.94 Favored 'General case' 0 N--CA 1.495 1.811 0 CA-C-N 119.628 1.104 . . . . 0.0 113.142 -177.174 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.4 37.43 18.71 Favored Glycine 0 N--CA 1.483 1.797 0 N-CA-C 117.769 1.868 . . . . 0.0 117.769 165.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 18.3 ttpt -68.54 -26.98 65.7 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-N 117.855 0.827 . . . . 0.0 113.047 177.537 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.65 ' HA ' ' HA ' ' A' ' 73' ' ' SER . 0.0 OUTLIER 77.61 121.36 0.05 OUTLIER 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 125.667 1.587 . . . . 0.0 110.263 -172.335 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 65.4 m-85 -119.32 170.19 9.33 Favored 'General case' 0 N--CA 1.47 0.539 0 C-N-CA 123.945 0.898 . . . . 0.0 110.554 176.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.688 ' HG3' ' HB2' ' A' ' 49' ' ' PHE . 1.7 mm-40 -68.93 -28.64 66.83 Favored 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 112.972 -1.922 . . . . 0.0 111.799 -175.141 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 11.5 ptmm? -162.58 165.77 25.54 Favored 'General case' 0 C--O 1.245 0.833 0 C-N-CA 123.935 0.894 . . . . 0.0 109.31 -177.403 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 66.2 mttm -60.65 -37.39 81.38 Favored 'General case' 0 N--CA 1.478 0.928 0 C-N-CA 124.106 0.962 . . . . 0.0 111.009 -178.606 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -63.85 -37.85 88.91 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 115.522 -0.763 . . . . 0.0 111.195 179.287 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.5 m -66.01 -29.97 70.44 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 122.966 0.506 . . . . 0.0 111.146 177.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 75.8 t -73.68 -48.58 39.68 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.063 0 C-N-CA 124.268 1.027 . . . . 0.0 110.237 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 71.0 t -73.61 -34.48 41.88 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.719 0 CA-C-N 114.989 -1.005 . . . . 0.0 109.874 -175.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.33 -37.2 86.35 Favored 'General case' 0 N--CA 1.476 0.836 0 CA-C-N 115.658 -0.701 . . . . 0.0 109.27 174.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -72.46 -32.65 66.43 Favored 'General case' 0 N--CA 1.483 1.183 0 CA-C-N 115.255 -0.884 . . . . 0.0 111.346 175.259 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -70.23 -36.68 74.68 Favored 'General case' 0 N--CA 1.48 1.026 0 C-N-CA 124.255 1.022 . . . . 0.0 109.362 -176.038 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.87 -36.36 83.02 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.694 -1.139 . . . . 0.0 110.749 175.075 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.0 mtpt -87.97 -47.76 8.3 Favored 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.386 -171.362 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 23.6 t -104.13 -6.23 21.26 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 123.994 0.917 . . . . 0.0 111.763 -166.984 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.2 m-70 -135.29 50.75 4.89 Favored Pre-proline 0 CA--C 1.57 1.736 0 CA-C-O 118.535 -0.745 . . . . 0.0 111.687 176.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 77.6 Cg_exo -51.47 -51.69 10.63 Favored 'Trans proline' 0 C--N 1.397 3.129 0 C-N-CA 122.606 2.204 . . . . 0.0 112.395 174.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 35.7 tt0 -141.88 96.23 2.94 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 108.007 -1.109 . . . . 0.0 108.007 171.744 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.251 1.159 0 C-N-CA 123.468 0.707 . . . . 0.0 110.032 176.865 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 45.5 m80 . . . . . 0 N--CA 1.481 1.081 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.8 ptm -134.42 -3.6 2.68 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.834 0.854 . . . . 0.0 110.721 174.087 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 99.5 mtt180 -84.76 63.31 7.92 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-O 121.799 0.809 . . . . 0.0 109.158 175.826 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.3 p-10 -148.53 95.5 2.45 Favored 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 124.8 1.24 . . . . 0.0 107.747 -179.592 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 13.4 m-85 -93.92 102.58 14.68 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 113.852 -1.522 . . . . 0.0 107.419 -178.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 33.0 mm -101.75 104.83 16.94 Favored 'Isoleucine or valine' 0 C--O 1.241 0.642 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.605 -166.505 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.425 ' O ' ' N ' ' A' ' 18' ' ' TYR . 7.6 t -60.04 92.95 0.02 OUTLIER 'General case' 0 C--O 1.221 -0.41 0 N-CA-C 107.808 -1.182 . . . . 0.0 107.808 160.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 32.23 -62.23 0.0 OUTLIER 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 128.772 2.829 . . . . 0.0 115.502 166.771 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.425 ' N ' ' O ' ' A' ' 16' ' ' CYS . 3.2 t80 -134.67 -41.9 0.77 Allowed 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.616 0.767 . . . . 0.0 110.155 -175.663 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -97.79 34.59 1.85 Allowed 'General case' 0 N--CA 1.48 1.05 0 CA-C-N 114.638 -1.165 . . . . 0.0 112.181 -170.718 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -131.37 122.54 26.52 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 122.783 0.433 . . . . 0.0 111.126 159.267 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 39.7 ptt180 -69.37 -53.01 21.67 Favored 'General case' 0 CA--C 1.549 0.929 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 168.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -174.69 125.8 0.29 Allowed 'General case' 0 C--N 1.362 1.141 0 C-N-CA 123.926 0.89 . . . . 0.0 109.868 163.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -96.82 146.49 24.87 Favored 'General case' 0 N--CA 1.469 0.508 0 N-CA-C 108.767 -0.827 . . . . 0.0 108.767 171.237 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 39.9 ttmt -67.05 -29.81 69.71 Favored 'General case' 0 CA--C 1.544 0.728 0 C-N-CA 122.946 0.499 . . . . 0.0 111.164 176.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 7.3 t -162.59 158.21 23.07 Favored 'General case' 0 CA--C 1.557 1.241 0 CA-C-O 120.993 0.425 . . . . 0.0 111.158 -173.426 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 91.8 p -65.25 -31.06 72.02 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 114.608 1.336 . . . . 0.0 114.608 -170.221 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 43.2 m80 -74.42 -36.7 63.46 Favored 'General case' 0 N--CA 1.497 1.903 0 CA-C-N 118.359 0.527 . . . . 0.0 111.043 177.521 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 11.7 t-20 -58.72 -48.29 81.65 Favored 'General case' 0 N--CA 1.49 1.547 0 CA-C-O 122.697 1.237 . . . . 0.0 109.606 174.017 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.8 tp -56.23 -43.53 78.7 Favored 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 112.801 -2.0 . . . . 0.0 112.383 169.86 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.408 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -57.9 -29.42 65.07 Favored 'General case' 0 N--CA 1.49 1.549 0 C-N-CA 123.801 0.84 . . . . 0.0 112.679 -179.754 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.485 ' HA ' ' HB ' ' A' ' 50' ' ' THR . 61.1 t -61.05 -46.82 95.92 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.072 0 C-N-CA 123.488 0.715 . . . . 0.0 110.532 176.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.8 t60 -73.81 -39.61 63.96 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 123.86 0.864 . . . . 0.0 111.069 174.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.408 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 43.0 ttt180 -69.35 -1.93 9.55 Favored 'General case' 0 CA--C 1.547 0.84 0 C-N-CA 124.685 1.194 . . . . 0.0 111.965 -173.562 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.543 ' SD ' ' NE2' ' A' ' 43' ' ' GLN . 24.9 ptt? -45.38 -16.5 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.074 0 C-N-CA 125.985 1.714 . . . . 0.0 114.79 174.156 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -86.77 -56.89 4.75 Favored 'Isoleucine or valine' 0 CA--C 1.569 1.706 0 C-N-CA 125.379 1.471 . . . . 0.0 110.046 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 0.0 OUTLIER -103.83 6.43 36.59 Favored 'General case' 0 N--CA 1.506 2.354 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -172.003 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.66 HG21 ' HD3' ' A' ' 41' ' ' PRO . 5.2 t -62.15 -49.66 74.97 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 113.553 0.946 . . . . 0.0 113.553 -169.212 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 84.28 -30.33 3.71 Favored Glycine 0 CA--C 1.537 1.419 0 CA-C-O 119.917 -0.38 . . . . 0.0 112.735 -169.885 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 46.2 mt-10 -70.03 -16.47 63.16 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 124.087 0.955 . . . . 0.0 113.217 178.69 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 45.08 82.14 0.24 Allowed Pre-proline 0 CA--C 1.563 1.476 0 C-N-CA 125.279 1.431 . . . . 0.0 112.706 -176.745 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . 0.66 ' HD3' HG21 ' A' ' 37' ' ' THR . 2.1 Cg_endo -83.3 173.58 9.7 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.292 2.661 . . . . 0.0 110.482 172.291 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 4.6 mp -97.92 131.37 44.44 Favored 'General case' 0 N--CA 1.468 0.472 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 -173.669 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.543 ' NE2' ' SD ' ' A' ' 34' ' ' MET . 33.4 tt0 -120.32 141.42 50.04 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 122.733 0.413 . . . . 0.0 110.503 -179.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.594 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 1.7 t -64.65 108.53 1.73 Allowed 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.645 0.778 . . . . 0.0 109.573 169.724 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -72.83 6.28 2.66 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.32 1.048 . . . . 0.0 112.644 -179.682 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.594 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 1.7 mp -90.73 -51.59 11.6 Favored 'Isoleucine or valine' 0 C--N 1.354 0.802 0 N-CA-C 106.694 -1.595 . . . . 0.0 106.694 -174.149 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 25.0 p -119.94 -112.75 0.33 Allowed 'General case' 0 N--CA 1.445 -0.701 0 N-CA-C 104.082 -2.562 . . . . 0.0 104.082 169.689 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.36 158.27 27.66 Favored Glycine 0 C--O 1.24 0.499 0 N-CA-C 108.253 -1.939 . . . . 0.0 108.253 157.026 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.439 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 61.7 t80 172.04 110.46 0.01 OUTLIER 'General case' 0 CA--C 1.514 -0.41 0 N-CA-C 102.216 -3.253 . . . . 0.0 102.216 -175.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.485 ' HB ' ' HA ' ' A' ' 31' ' ' VAL . 2.7 m -119.64 137.12 54.08 Favored 'General case' 0 C--O 1.24 0.577 0 N-CA-C 108.715 -0.846 . . . . 0.0 108.715 -167.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.499 ' SG ' ' HB3' ' A' ' 56' ' ' SER . 8.1 p -160.11 155.93 25.96 Favored 'General case' 0 C--O 1.241 0.629 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.994 -178.989 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -85.9 2.68 45.05 Favored 'General case' 0 CA--C 1.551 0.981 0 CA-C-N 115.422 -0.808 . . . . 0.0 110.515 175.044 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -105.21 103.99 13.63 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 124.548 1.139 . . . . 0.0 108.345 178.581 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 38.9 ttpt -50.73 -45.36 58.61 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.373 0.669 . . . . 0.0 111.268 175.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.65 -39.78 68.37 Favored 'General case' 0 N--CA 1.484 1.256 0 O-C-N 124.424 1.077 . . . . 0.0 112.783 179.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.499 ' HB3' ' SG ' ' A' ' 51' ' ' CYS . 22.9 t -61.47 -54.9 37.34 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.231 0.612 . . . . 0.0 111.79 -174.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.473 ' H ' HD23 ' A' ' 57' ' ' LEU . 1.1 pt? -75.14 -35.91 61.63 Favored 'General case' 0 N--CA 1.477 0.903 0 CA-C-O 119.122 -0.466 . . . . 0.0 111.793 179.071 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 8.6 t30 -50.66 -41.63 55.68 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.021 0.929 . . . . 0.0 112.733 179.757 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.433 ' O ' ' HG2' ' A' ' 63' ' ' LYS . 93.7 m95 -80.67 -54.53 5.55 Favored 'General case' 0 C--O 1.226 -0.167 0 CA-C-O 118.667 -0.683 . . . . 0.0 109.399 176.527 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 31.0 t60 -41.28 -46.63 3.26 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 113.993 1.109 . . . . 0.0 113.993 -179.038 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 23.4 ptm -61.52 -46.97 87.7 Favored 'General case' 0 CA--C 1.548 0.88 0 N-CA-C 112.446 0.536 . . . . 0.0 112.446 179.024 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 47.9 mtmt -68.42 -36.58 79.28 Favored 'General case' 0 N--CA 1.487 1.386 0 CA-C-O 121.489 0.661 . . . . 0.0 111.522 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.433 ' HG2' ' O ' ' A' ' 59' ' ' TRP . 29.4 mmmt -67.05 -33.94 76.6 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-N 114.505 -1.225 . . . . 0.0 111.017 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.513 ' HA ' ' HA ' ' A' ' 67' ' ' ASP . 0.2 OUTLIER -106.88 4.4 27.32 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 111.741 0.275 . . . . 0.0 111.741 179.293 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -66.1 -43.36 87.47 Favored 'General case' 0 N--CA 1.485 1.304 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 168.455 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -101.28 15.06 30.0 Favored 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.401 -1.272 . . . . 0.0 110.509 175.05 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.513 ' HA ' ' HA ' ' A' ' 64' ' ' HIS . 6.0 p-10 33.59 46.19 0.11 Allowed 'General case' 0 N--CA 1.497 1.9 0 C-N-CA 126.135 1.774 . . . . 0.0 114.172 -174.356 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.422 ' HA ' ' HB2' ' A' ' 73' ' ' SER . 19.9 m -62.59 -24.31 67.49 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.724 0.809 . . . . 0.0 113.132 -179.363 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 36.5 m-85 -93.7 -4.6 50.22 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 123.58 0.752 . . . . 0.0 112.383 178.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 81.1 t80 -65.21 -80.8 0.03 OUTLIER 'General case' 0 N--CA 1.483 1.186 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 95.2 mt-30 -104.54 -85.97 0.46 Allowed 'General case' 0 N--CA 1.473 0.721 0 N-CA-C 107.266 -1.383 . . . . 0.0 107.266 166.258 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.509 ' HB2' ' O ' ' A' ' 81' ' ' PHE . 64.4 m-85 -159.45 134.49 8.13 Favored 'General case' 0 C--O 1.24 0.583 0 N-CA-C 104.227 -2.508 . . . . 0.0 104.227 -177.755 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . 0.422 ' HB2' ' HA ' ' A' ' 68' ' ' SER . 38.1 m -142.81 162.8 34.51 Favored 'General case' 0 C--N 1.313 -1.013 0 CA-C-O 121.532 0.682 . . . . 0.0 111.446 -176.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 6.6 t -103.72 118.1 35.92 Favored 'General case' 0 C--N 1.328 -0.329 0 N-CA-C 106.151 -1.796 . . . . 0.0 106.151 167.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -65.56 -22.81 66.73 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 118.047 0.385 . . . . 0.0 111.377 -175.813 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 2.1 mt -84.24 -41.73 16.49 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 122.78 0.432 . . . . 0.0 111.499 -172.403 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 16.7 p -136.92 -0.61 2.28 Favored 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 113.192 0.812 . . . . 0.0 113.192 -176.578 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 61.3 39.15 96.83 Favored Glycine 0 C--N 1.352 1.441 0 N-CA-C 114.613 0.605 . . . . 0.0 114.613 175.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 10.3 tmtt? -64.49 -38.0 89.49 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.016 0.526 . . . . 0.0 111.212 -176.193 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt 74.64 114.81 0.06 Allowed 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 125.449 1.499 . . . . 0.0 110.014 176.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.509 ' O ' ' HB2' ' A' ' 72' ' ' PHE . 91.6 m-85 -122.19 163.63 19.23 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.302 0.641 . . . . 0.0 109.937 -179.093 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mt-10 -82.99 -1.4 52.47 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 176.57 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -158.62 144.67 16.89 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 123.671 0.788 . . . . 0.0 108.919 172.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.412 ' HG3' ' HD1' ' A' ' 72' ' ' PHE . 57.5 mtpt -58.22 -27.52 64.0 Favored 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 124.459 1.104 . . . . 0.0 110.937 174.542 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -54.54 -44.7 73.06 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.544 0.738 . . . . 0.0 110.813 173.891 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 50.6 m -70.24 -29.04 65.74 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 115.835 -0.62 . . . . 0.0 111.509 179.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.27 -45.35 61.61 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.213 0 C-N-CA 123.972 0.909 . . . . 0.0 110.494 -176.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 88.5 t -71.44 -37.6 65.26 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.997 0 C-N-CA 124.341 1.056 . . . . 0.0 109.147 -176.497 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.7 -36.63 78.72 Favored 'General case' 0 CA--C 1.542 0.663 0 CA-C-N 114.698 -1.137 . . . . 0.0 109.847 177.558 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.8 t60 -72.13 -33.89 68.14 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 115.103 -0.953 . . . . 0.0 111.449 177.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 38.6 ttpt -73.59 -33.28 64.54 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-O 121.349 0.595 . . . . 0.0 109.482 -177.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.81 -31.58 71.54 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 115.119 -0.946 . . . . 0.0 111.016 174.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 49.2 mttp -87.96 -58.77 2.45 Favored 'General case' 0 N--CA 1.485 1.307 0 CA-C-O 121.473 0.654 . . . . 0.0 111.448 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 33.5 t -91.78 -8.18 47.48 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.878 1.271 . . . . 0.0 111.554 -167.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 68.7 m-70 -136.17 54.15 9.15 Favored Pre-proline 0 CA--C 1.564 1.514 0 C-N-CA 123.112 0.565 . . . . 0.0 111.084 179.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 69.4 Cg_endo -70.99 -27.81 20.13 Favored 'Trans proline' 0 C--N 1.383 2.375 0 C-N-CA 121.978 1.786 . . . . 0.0 112.42 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 22.9 tt0 -139.65 100.18 3.9 Favored 'General case' 0 CA--C 1.544 0.736 0 C-N-CA 124.189 0.996 . . . . 0.0 109.161 177.833 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 77.0 t . . . . . 0 C--O 1.253 1.253 0 C-N-CA 123.959 0.904 . . . . 0.0 108.678 172.412 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.4 m80 . . . . . 0 N--CA 1.481 1.083 0 N-CA-C 109.759 -0.46 . . . . 0.0 109.759 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 1.4 mpt? -64.1 91.63 0.07 Allowed 'General case' 0 N--CA 1.477 0.888 0 O-C-N 124.021 0.826 . . . . 0.0 111.126 -176.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 50.4 ttp180 -169.23 48.02 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.718 0 N-CA-C 107.838 -1.171 . . . . 0.0 107.838 175.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.6 m-20 -127.15 89.38 2.96 Favored 'General case' 0 N--CA 1.47 0.566 0 N-CA-C 108.42 -0.956 . . . . 0.0 108.42 -174.167 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . 0.449 ' HB2' ' HB2' ' A' ' 23' ' ' PHE . 63.0 m-85 -93.09 113.75 26.09 Favored 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 115.171 -0.922 . . . . 0.0 109.197 178.916 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.77 HG22 ' H ' ' A' ' 17' ' ' GLU . 9.5 mm -119.69 158.67 21.25 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.821 0 C-N-CA 124.562 1.145 . . . . 0.0 108.491 -170.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.63 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 48.9 t -104.39 -10.03 18.04 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.828 0.851 . . . . 0.0 110.572 176.948 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.77 ' H ' HG22 ' A' ' 15' ' ' ILE . 3.1 mp0 88.65 -16.49 0.3 Allowed 'General case' 0 N--CA 1.496 1.86 0 C-N-CA 126.745 2.018 . . . . 0.0 112.391 170.131 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -134.86 -51.54 0.78 Allowed 'General case' 0 N--CA 1.475 0.789 0 N-CA-C 108.964 -0.754 . . . . 0.0 108.964 178.319 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 3.9 p -122.67 74.2 1.18 Allowed 'General case' 0 C--O 1.215 -0.734 0 CA-C-N 114.678 -1.146 . . . . 0.0 110.698 178.995 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.63 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -164.13 146.23 8.99 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-O 121.58 0.705 . . . . 0.0 112.229 159.726 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 13.2 ptp180 -77.9 -171.26 2.2 Favored 'General case' 0 CA--C 1.548 0.87 0 CA-C-N 113.831 -1.531 . . . . 0.0 108.979 162.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -82.61 125.24 30.96 Favored 'General case' 0 CA--C 1.536 0.424 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 176.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.476 ' HB3' ' HB2' ' A' ' 28' ' ' ASN . 67.9 m-85 -110.23 147.54 33.58 Favored 'General case' 0 N--CA 1.469 0.504 0 C-N-CA 123.058 0.543 . . . . 0.0 110.654 178.193 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 93.6 mttt -58.62 -37.22 75.43 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 124.119 0.968 . . . . 0.0 112.38 175.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 43.6 t -147.59 156.05 42.42 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-O 121.061 0.458 . . . . 0.0 111.103 -167.814 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 58.2 p -57.02 -27.08 61.3 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 114.662 -1.153 . . . . 0.0 111.551 171.282 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 36.7 t60 -70.99 -41.04 71.49 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 122.945 0.498 . . . . 0.0 110.625 176.751 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.476 ' HB2' ' HB3' ' A' ' 23' ' ' PHE . 2.3 m-20 -60.75 -49.62 76.78 Favored 'General case' 0 N--CA 1.486 1.342 0 CA-C-O 122.021 0.915 . . . . 0.0 110.209 -179.925 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 6.1 tp -63.83 -35.56 81.02 Favored 'General case' 0 CA--C 1.547 0.858 0 CA-C-N 113.901 -1.5 . . . . 0.0 111.45 172.953 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.95 -31.98 71.52 Favored 'General case' 0 N--CA 1.5 2.054 0 C-N-CA 123.444 0.697 . . . . 0.0 112.443 175.136 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.502 HG13 ' HB ' ' A' ' 50' ' ' THR . 79.0 t -64.08 -49.4 81.64 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 174.658 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 34.9 t60 -60.07 -39.18 85.17 Favored 'General case' 0 N--CA 1.488 1.431 0 C-N-CA 123.773 0.829 . . . . 0.0 110.913 174.543 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 57.3 ttt180 -67.13 2.09 1.72 Allowed 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 125.07 1.348 . . . . 0.0 111.73 -175.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 22.9 ptp -44.97 -22.95 0.11 Allowed 'General case' 0 N--CA 1.494 1.767 0 C-N-CA 125.58 1.552 . . . . 0.0 113.482 172.897 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.0 OUTLIER -87.11 -50.59 13.79 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.268 0 C-N-CA 124.772 1.229 . . . . 0.0 110.042 178.026 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -98.26 6.44 47.4 Favored 'General case' 0 N--CA 1.504 2.236 0 C-N-CA 123.162 0.585 . . . . 0.0 111.638 -171.421 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -58.84 -60.19 4.23 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 113.996 1.109 . . . . 0.0 113.996 -164.59 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 74.48 -32.19 0.99 Allowed Glycine 0 CA--C 1.536 1.394 0 C-N-CA 122.929 0.3 . . . . 0.0 113.335 -168.899 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -69.17 -42.83 75.37 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.749 1.219 . . . . 0.0 110.16 171.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 99.1 mttt 68.4 100.76 0.04 OUTLIER Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 125.729 1.611 . . . . 0.0 111.091 -171.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 73.3 Cg_endo -70.87 -162.81 0.11 Allowed 'Trans proline' 0 C--N 1.377 2.034 0 C-N-CA 122.815 2.343 . . . . 0.0 111.603 170.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.443 HD13 ' N ' ' A' ' 54' ' ' LYS . 43.7 mt -100.01 106.34 18.11 Favored 'General case' 0 CA--C 1.535 0.378 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.221 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 51.8 tt0 -132.33 135.51 46.23 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 123.539 0.736 . . . . 0.0 110.236 -169.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.42 ' HB3' ' HB3' ' A' ' 49' ' ' PHE . 1.2 t -65.32 107.79 1.73 Allowed 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 124.108 0.963 . . . . 0.0 110.805 178.824 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -87.96 56.38 3.85 Favored 'General case' 0 CA--C 1.547 0.856 0 CA-C-O 121.899 0.857 . . . . 0.0 110.811 178.031 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 23.9 mm -125.93 -54.35 1.96 Allowed 'Isoleucine or valine' 0 C--O 1.232 0.176 0 N-CA-C 105.677 -1.972 . . . . 0.0 105.677 164.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.555 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 16.5 p -119.37 -116.99 0.32 Allowed 'General case' 0 N--CA 1.439 -0.976 0 N-CA-C 103.323 -2.843 . . . . 0.0 103.323 176.359 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.555 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -146.15 164.07 28.33 Favored Glycine 0 CA--C 1.526 0.776 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 155.016 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.42 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 8.1 t80 171.25 113.1 0.01 OUTLIER 'General case' 0 C--N 1.348 0.511 0 N-CA-C 101.794 -3.41 . . . . 0.0 101.794 -174.204 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.502 ' HB ' HG13 ' A' ' 31' ' ' VAL . 8.0 m -121.75 129.5 52.74 Favored 'General case' 0 C--O 1.241 0.632 0 N-CA-C 108.931 -0.766 . . . . 0.0 108.931 -170.206 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 52.6 t -141.01 163.12 33.83 Favored 'General case' 0 C--N 1.31 -1.142 0 CA-C-N 114.356 -1.293 . . . . 0.0 110.637 -175.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 8.7 ptm180 -76.47 -21.04 56.37 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 114.905 -1.043 . . . . 0.0 111.493 175.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.0 tp-100 -117.76 116.23 26.6 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 124.483 1.113 . . . . 0.0 109.636 -177.113 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.443 ' N ' HD13 ' A' ' 42' ' ' LEU . 63.4 tttm -57.61 -34.77 69.62 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 124.142 0.977 . . . . 0.0 111.801 178.461 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.65 70.97 Favored 'General case' 0 CA--C 1.554 1.122 0 O-C-N 123.846 0.716 . . . . 0.0 112.301 176.654 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 30.9 t -61.85 -55.27 31.63 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 122.745 0.418 . . . . 0.0 111.3 -178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.402 ' HA ' ' HB3' ' A' ' 60' ' ' HIS . 0.3 OUTLIER -71.26 -27.93 63.8 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.133 0.573 . . . . 0.0 111.687 178.844 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -52.58 -44.12 65.72 Favored 'General case' 0 N--CA 1.483 1.183 0 C-N-CA 123.721 0.808 . . . . 0.0 112.396 171.396 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 25.0 m95 -76.72 -45.83 27.8 Favored 'General case' 0 N--CA 1.477 0.897 0 N-CA-C 108.957 -0.757 . . . . 0.0 108.957 -177.48 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.402 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 63.8 t60 -45.94 -40.93 10.92 Favored 'General case' 0 CA--C 1.57 1.742 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 168.14 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.43 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 66.8 mtm -71.82 -37.4 70.36 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.384 -0.823 . . . . 0.0 112.624 174.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 24.9 ttpp -56.89 -32.15 65.59 Favored 'General case' 0 N--CA 1.488 1.462 0 CA-C-O 121.054 0.454 . . . . 0.0 111.247 168.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 97.7 mttt -67.96 -42.39 81.0 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-N 115.731 -0.668 . . . . 0.0 110.4 176.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 84.7 m-70 -56.98 -35.81 69.61 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.235 0.614 . . . . 0.0 111.389 171.541 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 24.7 t70 -72.12 -11.65 60.84 Favored 'General case' 0 CA--C 1.557 1.243 0 C-N-CA 123.03 0.532 . . . . 0.0 110.277 -174.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.8 -4.01 19.78 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.972 0.909 . . . . 0.0 112.226 -177.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 1.2 p-10 -156.61 -41.92 0.07 Allowed 'General case' 0 N--CA 1.497 1.888 0 CA-C-N 119.607 1.094 . . . . 0.0 113.368 -174.635 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 28.8 t -64.57 -10.33 25.4 Favored 'General case' 0 N--CA 1.483 1.211 0 N-CA-C 114.77 1.396 . . . . 0.0 114.77 -165.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 59.8 m-85 -122.37 7.75 9.62 Favored 'General case' 0 CA--C 1.543 0.694 0 O-C-N 121.862 -0.524 . . . . 0.0 109.872 -170.47 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 79.2 t80 -142.42 -35.21 0.43 Allowed 'General case' 0 C--N 1.361 1.104 0 N-CA-C 112.73 0.641 . . . . 0.0 112.73 -178.23 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 17.5 mm100 -82.19 -55.71 4.38 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.48 0.312 . . . . 0.0 111.148 -164.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 20.3 m-85 -143.87 131.24 20.92 Favored 'General case' 0 C--N 1.346 0.441 0 N-CA-C 105.714 -1.958 . . . . 0.0 105.714 -177.355 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 68.5 p -161.38 123.46 2.99 Favored 'General case' 0 C--N 1.304 -1.386 0 N-CA-C 106.338 -1.727 . . . . 0.0 106.338 175.398 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 35.8 t -67.42 115.58 7.21 Favored 'General case' 0 C--N 1.327 -0.394 0 N-CA-C 108.307 -0.997 . . . . 0.0 108.307 172.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 1.5 m-20 -61.24 -19.25 61.46 Favored 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 123.182 0.593 . . . . 0.0 111.707 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 5.6 mt -96.12 -42.97 12.51 Favored 'Isoleucine or valine' 0 CA--C 1.557 1.232 0 C-N-CA 123.62 0.768 . . . . 0.0 112.149 -175.432 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . 0.607 ' SG ' ' HB2' ' A' ' 79' ' ' LYS . 17.8 p -135.29 -5.11 2.33 Favored 'General case' 0 N--CA 1.493 1.684 0 CA-C-N 119.44 1.018 . . . . 0.0 113.24 -176.837 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.57 32.25 77.57 Favored Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.102 0.382 . . . . 0.0 113.873 176.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.607 ' HB2' ' SG ' ' A' ' 77' ' ' CYS . 52.9 tttm -69.89 -15.8 63.13 Favored 'General case' 0 CA--C 1.562 1.427 0 N-CA-C 113.598 0.962 . . . . 0.0 113.598 -170.243 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 30.9 mmmt 76.13 112.68 0.07 Allowed 'General case' 0 N--CA 1.492 1.644 0 C-N-CA 124.52 1.128 . . . . 0.0 111.933 167.13 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -133.87 148.62 51.28 Favored 'General case' 0 N--CA 1.493 1.724 0 C-N-CA 123.598 0.759 . . . . 0.0 111.847 -175.626 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -67.57 -18.48 65.02 Favored 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 124.907 1.283 . . . . 0.0 113.821 -174.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.488 ' HG3' ' H ' ' A' ' 86' ' ' SER . 0.3 OUTLIER -144.84 148.31 33.85 Favored 'General case' 0 C--N 1.349 0.57 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 176.851 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -64.46 -29.99 71.03 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.658 0.783 . . . . 0.0 110.288 179.686 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 28.1 t70 -56.6 -41.67 77.42 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.222 -0.899 . . . . 0.0 111.295 170.736 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.488 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 43.3 t -69.02 -30.42 68.79 Favored 'General case' 0 C--O 1.217 -0.612 0 C-N-CA 122.951 0.5 . . . . 0.0 110.944 -179.58 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 70.0 t -72.56 -44.49 61.01 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.127 0 C-N-CA 123.737 0.815 . . . . 0.0 109.745 -176.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 76.0 t -74.13 -36.35 43.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.646 0 CA-C-N 114.194 -1.366 . . . . 0.0 110.141 -178.292 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.22 -40.44 94.11 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-N 115.456 -0.793 . . . . 0.0 108.936 174.387 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -69.97 -29.64 66.8 Favored 'General case' 0 C--O 1.209 -1.073 0 CA-C-N 114.614 -1.175 . . . . 0.0 110.765 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 33.5 ttmt -72.09 -40.79 67.98 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-O 121.466 0.65 . . . . 0.0 109.77 -179.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -70.16 -24.0 63.08 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-N 114.86 -1.064 . . . . 0.0 111.637 178.202 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 76.8 tttt -98.78 -51.69 3.82 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 124.373 1.069 . . . . 0.0 112.029 -174.618 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 41.3 t -92.85 -14.03 28.26 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 124.858 1.263 . . . . 0.0 111.405 -169.84 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.619 ' HB3' HG22 ' A' ' 98' ' ' VAL . 64.4 m-70 -131.37 56.16 22.97 Favored Pre-proline 0 CA--C 1.556 1.199 0 C-N-CA 122.835 0.454 . . . . 0.0 110.956 179.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 56.7 Cg_endo -68.38 -32.19 26.35 Favored 'Trans proline' 0 C--N 1.387 2.57 0 C-N-CA 122.002 1.802 . . . . 0.0 111.282 175.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -127.35 99.3 5.59 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 107.096 -1.446 . . . . 0.0 107.096 173.065 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.619 HG22 ' HB3' ' A' ' 95' ' ' HIS . 41.4 t . . . . . 0 C--O 1.252 1.195 0 CA-C-N 115.229 -0.896 . . . . 0.0 109.464 177.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 5.2 t60 . . . . . 0 N--CA 1.474 0.754 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 54.7 ttp -136.12 -47.66 0.65 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 123.485 0.714 . . . . 0.0 110.069 -177.364 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 73.9 ttt180 -122.39 51.63 1.37 Allowed 'General case' 0 CA--C 1.546 0.798 0 N-CA-C 107.812 -1.181 . . . . 0.0 107.812 178.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -125.92 83.92 2.22 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.514 -1.221 . . . . 0.0 107.909 -173.942 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -81.93 115.3 21.04 Favored 'General case' 0 C--N 1.316 -0.869 0 CA-C-N 113.9 -1.5 . . . . 0.0 110.024 -175.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.418 HG22 ' H ' ' A' ' 17' ' ' GLU . 15.4 mm -105.31 137.49 34.64 Favored 'Isoleucine or valine' 0 C--O 1.239 0.517 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 -175.527 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.654 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 43.5 t -80.93 -24.73 37.96 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 123.211 0.604 . . . . 0.0 110.256 178.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.418 ' H ' HG22 ' A' ' 15' ' ' ILE . 35.4 tt0 117.5 -28.63 0.01 OUTLIER 'General case' 0 N--CA 1.509 2.516 0 C-N-CA 127.728 2.411 . . . . 0.0 110.541 167.05 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 6.8 t80 -133.06 -42.4 0.89 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 124.114 0.966 . . . . 0.0 108.587 -173.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -123.56 66.76 1.01 Allowed 'General case' 0 C--O 1.242 0.68 0 CA-C-N 114.714 -1.13 . . . . 0.0 111.242 -178.386 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.654 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -166.04 124.2 1.5 Allowed 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 115.187 -0.915 . . . . 0.0 110.989 162.095 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 8.9 ptt-85 -67.74 -52.73 34.01 Favored 'General case' 0 CA--C 1.552 1.036 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 169.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -178.05 132.11 0.15 Allowed 'General case' 0 C--N 1.356 0.853 0 C-N-CA 125.393 1.477 . . . . 0.0 108.575 163.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 74.8 m-85 -100.17 135.2 41.96 Favored 'General case' 0 N--CA 1.466 0.374 0 N-CA-C 108.457 -0.942 . . . . 0.0 108.457 170.996 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 22.7 ptmt -73.79 -10.99 60.23 Favored 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 123.262 0.625 . . . . 0.0 111.375 178.998 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 70.6 m -146.91 134.99 21.54 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 122.751 0.42 . . . . 0.0 110.833 -175.317 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.636 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.1 m -59.82 -34.82 73.57 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 124.432 1.093 . . . . 0.0 111.588 176.012 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 31.9 t-80 -62.36 -44.81 95.61 Favored 'General case' 0 N--CA 1.475 0.802 0 C-N-CA 124.045 0.938 . . . . 0.0 110.748 176.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 65.2 t30 -66.89 -42.53 85.35 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-O 121.359 0.6 . . . . 0.0 110.739 -177.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.636 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.1 OUTLIER -62.68 -34.87 78.01 Favored 'General case' 0 N--CA 1.475 0.776 0 CA-C-N 114.947 -1.024 . . . . 0.0 110.439 177.195 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.49 -29.67 69.16 Favored 'General case' 0 N--CA 1.483 1.177 0 O-C-N 123.754 0.659 . . . . 0.0 111.985 177.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.424 HG21 ' HD3' ' A' ' 52' ' ' ARG . 39.6 t -63.92 -47.76 89.2 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.276 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 174.74 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 6.4 t60 -62.87 -39.9 95.85 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.194 0.998 . . . . 0.0 110.534 174.715 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 41.8 ttt180 -68.62 5.94 0.95 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.41 1.084 . . . . 0.0 111.842 -173.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.412 ' HE2' ' HB ' ' A' ' 50' ' ' THR . 25.6 ptp -42.87 -20.8 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.938 0 C-N-CA 126.512 1.925 . . . . 0.0 114.853 176.313 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -86.32 -58.46 3.45 Favored 'Isoleucine or valine' 0 CA--C 1.56 1.345 0 C-N-CA 125.172 1.389 . . . . 0.0 108.637 178.676 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.44 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.54 10.52 37.03 Favored 'General case' 0 N--CA 1.501 2.113 0 C-N-CA 124.458 1.103 . . . . 0.0 113.137 -170.345 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.415 ' OG1' ' HB2' ' A' ' 39' ' ' GLU . 4.5 t -57.8 -65.12 0.69 Allowed 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 114.4 1.259 . . . . 0.0 114.4 -164.485 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 66.67 36.4 91.24 Favored Glycine 0 N--CA 1.476 1.357 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 -174.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.415 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 37.1 mt-10 -149.86 -34.77 0.17 Allowed 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.902 1.681 . . . . 0.0 107.781 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt 46.77 75.93 0.61 Allowed Pre-proline 0 C--N 1.371 1.539 0 C-N-CA 126.263 1.825 . . . . 0.0 111.497 178.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 29.0 Cg_endo -59.36 -74.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.382 2.33 0 C-N-CA 123.107 2.538 . . . . 0.0 111.842 -177.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . 0.458 ' HB2' ' O ' ' A' ' 51' ' ' CYS . 95.4 mt -145.49 98.94 3.22 Favored 'General case' 0 N--CA 1.474 0.727 0 N-CA-C 106.766 -1.568 . . . . 0.0 106.766 170.98 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.443 ' HG2' ' OG1' ' A' ' 50' ' ' THR . 0.1 OUTLIER -129.85 141.76 50.78 Favored 'General case' 0 CA--C 1.541 0.598 0 N-CA-C 107.171 -1.418 . . . . 0.0 107.171 -168.444 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 31.6 t -66.1 102.9 0.87 Allowed 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 109.266 -0.642 . . . . 0.0 109.266 174.272 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . 0.422 ' H ' ' CD ' ' A' ' 45' ' ' GLU . 0.9 OUTLIER -73.97 -1.47 19.94 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.828 0.851 . . . . 0.0 111.945 177.969 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.515 HD11 ' SD ' ' A' ' 61' ' ' MET . 3.4 mp -83.8 -55.6 6.91 Favored 'Isoleucine or valine' 0 C--N 1.35 0.63 0 N-CA-C 107.103 -1.444 . . . . 0.0 107.103 174.551 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.476 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 18.3 p -132.58 -97.92 0.3 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.218 -0.446 . . . . 0.0 110.396 176.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.476 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -155.46 131.19 3.0 Favored Glycine 0 N--CA 1.47 0.923 0 CA-C-O 116.906 -2.052 . . . . 0.0 109.078 -174.58 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 35.0 t80 164.83 113.56 0.01 OUTLIER 'General case' 0 C--N 1.354 0.804 0 N-CA-C 102.402 -3.184 . . . . 0.0 102.402 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.443 ' OG1' ' HG2' ' A' ' 43' ' ' GLN . 3.1 m -128.42 126.51 40.72 Favored 'General case' 0 C--O 1.231 0.131 0 N-CA-C 109.033 -0.728 . . . . 0.0 109.033 -168.682 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.458 ' O ' ' HB2' ' A' ' 42' ' ' LEU . 96.4 m -150.45 141.74 23.25 Favored 'General case' 0 C--N 1.298 -1.666 0 CA-C-N 115.193 -0.912 . . . . 0.0 109.442 -175.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.424 ' HD3' HG21 ' A' ' 31' ' ' VAL . 29.9 ptt180 -69.66 -12.19 61.44 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.588 0.755 . . . . 0.0 111.147 176.391 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 15.8 mm-40 -101.02 107.76 19.3 Favored 'General case' 0 C--N 1.345 0.392 0 N-CA-C 108.558 -0.905 . . . . 0.0 108.558 173.322 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -48.35 -41.77 29.51 Favored 'General case' 0 N--CA 1.482 1.175 0 C-N-CA 125.127 1.371 . . . . 0.0 111.65 176.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -55.87 -29.48 59.99 Favored 'General case' 0 CA--C 1.556 1.211 0 CA-C-N 114.68 -1.145 . . . . 0.0 113.023 178.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 20.2 m -69.41 -56.34 7.74 Favored 'General case' 0 N--CA 1.483 1.22 0 O-C-N 122.134 -0.354 . . . . 0.0 111.816 179.354 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.44 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.4 OUTLIER -75.68 -48.49 21.78 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -175.215 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 4.1 m-20 -55.89 -31.38 62.78 Favored 'General case' 0 N--CA 1.487 1.404 0 N-CA-C 112.868 0.692 . . . . 0.0 112.868 -179.261 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.446 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 27.2 m95 -83.98 -39.59 19.53 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-O 119.207 -0.425 . . . . 0.0 110.305 178.12 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . . . . . . . . . 9.0 t60 -45.88 -37.86 6.76 Favored 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 113.141 0.793 . . . . 0.0 113.141 164.925 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.515 ' SD ' HD11 ' A' ' 46' ' ' ILE . 23.0 ttp -62.61 -47.03 85.57 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.754 0.822 . . . . 0.0 111.252 174.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 25.5 mtpp -60.75 -36.97 80.26 Favored 'General case' 0 CA--C 1.557 1.247 0 C-N-CA 123.538 0.735 . . . . 0.0 111.24 174.267 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.446 ' HG3' ' O ' ' A' ' 59' ' ' TRP . 64.2 mttm -62.58 -33.94 75.97 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.624 0.769 . . . . 0.0 111.255 175.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.47 ' HB2' ' HA ' ' A' ' 67' ' ' ASP . 3.1 p80 -107.56 23.69 14.06 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.263 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 31.9 t70 -53.37 -34.71 58.71 Favored 'General case' 0 N--CA 1.485 1.309 0 CA-C-O 121.19 0.519 . . . . 0.0 110.097 157.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -83.04 -30.04 28.37 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.991 0.916 . . . . 0.0 111.682 173.765 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . 0.47 ' HA ' ' HB2' ' A' ' 64' ' ' HIS . 17.7 m-20 84.34 -55.91 0.12 Allowed 'General case' 0 N--CA 1.492 1.643 0 C-N-CA 126.651 1.98 . . . . 0.0 113.758 170.958 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 16.9 p -45.04 -34.62 2.6 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 116.047 1.869 . . . . 0.0 116.047 -166.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 60.3 m-85 -104.69 0.08 28.0 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.913 0.709 . . . . 0.0 112.913 -171.754 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.46 ' HB2' ' HB3' ' A' ' 64' ' ' HIS . 54.2 m-85 -150.27 32.35 0.66 Allowed 'General case' 0 N--CA 1.492 1.657 0 C-N-CA 123.492 0.717 . . . . 0.0 111.41 -174.428 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . 0.41 ' HG3' ' O ' ' A' ' 67' ' ' ASP . 39.2 mt-30 -86.17 -21.14 27.68 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 122.384 0.274 . . . . 0.0 110.487 172.792 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 4.9 m-85 -140.69 131.56 25.96 Favored 'General case' 0 C--N 1.346 0.439 0 N-CA-C 104.51 -2.404 . . . . 0.0 104.51 -179.231 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 31.9 t -158.36 153.94 26.2 Favored 'General case' 0 C--N 1.311 -1.07 0 C-N-CA 123.53 0.732 . . . . 0.0 110.359 177.371 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 8.2 t -89.12 118.81 29.11 Favored 'General case' 0 C--O 1.224 -0.25 0 N-CA-C 105.944 -1.872 . . . . 0.0 105.944 168.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 8.0 t30 -66.41 -19.81 65.9 Favored 'General case' 0 CA--C 1.551 1.007 0 CA-C-O 121.024 0.44 . . . . 0.0 111.501 179.418 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.3 mt -88.15 -37.32 10.39 Favored 'Isoleucine or valine' 0 CA--C 1.558 1.279 0 C-N-CA 123.029 0.532 . . . . 0.0 111.785 -173.574 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 19.3 p -150.33 17.07 0.83 Allowed 'General case' 0 C--N 1.377 1.778 0 CA-C-N 119.449 1.022 . . . . 0.0 113.393 -179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 49.35 46.48 35.81 Favored Glycine 0 C--N 1.352 1.417 0 N-CA-C 117.286 1.675 . . . . 0.0 117.286 160.77 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -64.68 -45.1 88.09 Favored 'General case' 0 N--CA 1.48 1.062 0 CA-C-N 117.313 0.557 . . . . 0.0 111.241 173.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 69.07 112.72 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.484 1.114 . . . . 0.0 109.447 -167.813 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 90.0 m-85 -111.32 167.89 9.95 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 124.209 1.004 . . . . 0.0 110.625 -177.773 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -68.29 -31.51 71.0 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 123.179 0.592 . . . . 0.0 112.473 175.668 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.411 ' HG2' ' H ' ' A' ' 86' ' ' SER . 0.0 OUTLIER -139.7 155.59 47.28 Favored 'General case' 0 C--O 1.24 0.59 0 CA-C-O 121.068 0.461 . . . . 0.0 110.403 177.872 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 48.5 mtmt -62.43 -31.14 71.8 Favored 'General case' 0 N--CA 1.475 0.8 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.305 175.932 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -59.28 -38.54 80.4 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.513 0.725 . . . . 0.0 110.592 178.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.411 ' H ' ' HG2' ' A' ' 83' ' ' LYS . 67.6 m -70.28 -29.63 66.44 Favored 'General case' 0 C--N 1.36 1.025 0 C-N-CA 122.764 0.426 . . . . 0.0 111.571 176.06 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 67.1 t -72.06 -43.8 66.63 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.361 0 C-N-CA 123.422 0.689 . . . . 0.0 109.688 -177.833 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 80.6 t -71.57 -38.26 66.85 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 124.955 1.302 . . . . 0.0 109.239 -178.835 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -65.69 -38.01 88.06 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.74 -1.118 . . . . 0.0 109.71 176.483 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 23.5 t60 -72.32 -40.91 67.13 Favored 'General case' 0 N--CA 1.477 0.9 0 CA-C-N 114.702 -1.136 . . . . 0.0 111.479 179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.1 tmmt? -70.69 -38.6 73.71 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 123.77 0.828 . . . . 0.0 109.362 -173.381 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -67.62 -28.81 68.05 Favored 'General case' 0 CA--C 1.546 0.821 0 CA-C-N 115.219 -0.9 . . . . 0.0 111.451 177.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 54.1 tttp -91.62 -45.07 8.67 Favored 'General case' 0 CA--C 1.551 0.989 0 C-N-CA 123.872 0.869 . . . . 0.0 111.207 -173.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 43.5 t -94.08 -23.35 18.01 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 124.746 1.219 . . . . 0.0 111.191 -169.507 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 34.4 m-70 -129.37 50.47 5.97 Favored Pre-proline 0 CA--C 1.569 1.677 0 N-CA-C 113.056 0.761 . . . . 0.0 113.056 -176.388 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 72.3 Cg_endo -79.48 -37.96 0.45 Allowed 'Trans proline' 0 C--N 1.385 2.488 0 C-N-CA 121.67 1.58 . . . . 0.0 111.45 167.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 13.4 tp10 -104.5 96.91 6.92 Favored 'General case' 0 C--N 1.348 0.528 0 N-CA-C 107.913 -1.143 . . . . 0.0 107.913 176.409 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 63.2 t . . . . . 0 CA--C 1.555 1.162 0 CA-C-N 114.776 -1.102 . . . . 0.0 108.38 170.808 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 43.9 p-80 . . . . . 0 N--CA 1.476 0.872 0 CA-C-O 121.321 0.581 . . . . 0.0 109.465 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 43.1 ttm -171.21 -45.91 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 124.599 1.16 . . . . 0.0 107.966 -179.309 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.8 ptt180 -149.41 37.12 0.75 Allowed 'General case' 0 CA--C 1.545 0.774 0 CA-C-N 114.243 -1.344 . . . . 0.0 107.906 173.954 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -106.66 80.98 1.52 Allowed 'General case' 0 C--O 1.235 0.325 0 N-CA-C 107.914 -1.143 . . . . 0.0 107.914 -169.267 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.0 m-85 -81.97 104.23 12.18 Favored 'General case' 0 C--N 1.318 -0.797 0 CA-C-N 114.996 -1.002 . . . . 0.0 108.842 179.59 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 25.9 mm -113.38 157.59 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.055 0 C-N-CA 124.286 1.034 . . . . 0.0 109.777 -171.046 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 10.9 t -119.75 37.15 4.28 Favored 'General case' 0 CA--C 1.548 0.884 0 C-N-CA 125.267 1.427 . . . . 0.0 108.149 -173.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 26.5 tt0 53.17 -37.46 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.053 0 C-N-CA 127.827 2.451 . . . . 0.0 117.144 -172.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 8.5 t80 -133.86 -48.84 0.81 Allowed 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 123.899 0.88 . . . . 0.0 110.629 -167.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.7 p -113.5 29.98 7.58 Favored 'General case' 0 N--CA 1.488 1.437 0 CA-C-N 115.075 -0.966 . . . . 0.0 112.954 -168.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -113.29 142.11 46.22 Favored 'General case' 0 C--O 1.241 0.621 0 CA-C-O 121.89 0.852 . . . . 0.0 111.825 167.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.404 ' HG2' ' H ' ' A' ' 21' ' ' ARG . 13.9 ptp180 -72.54 -114.53 0.0 OUTLIER 'General case' 0 CA--C 1.556 1.177 0 CA-C-N 113.363 -1.744 . . . . 0.0 108.178 164.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -137.2 124.41 21.75 Favored 'General case' 0 N--CA 1.466 0.366 0 N-CA-C 107.283 -1.377 . . . . 0.0 107.283 161.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.5 m-85 -109.1 136.6 48.33 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.467 -1.309 . . . . 0.0 107.467 177.118 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 64.8 pttt -87.98 0.71 55.57 Favored 'General case' 0 N--CA 1.479 0.989 0 N-CA-C 111.917 0.34 . . . . 0.0 111.917 -175.287 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 23.0 t -146.26 140.4 26.48 Favored 'General case' 0 CA--C 1.554 1.112 0 C-N-CA 122.885 0.474 . . . . 0.0 110.126 -173.136 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 15.0 m -46.09 -56.77 5.16 Favored 'General case' 0 N--CA 1.492 1.662 0 C-N-CA 125.361 1.465 . . . . 0.0 113.266 177.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.452 ' O ' HG23 ' A' ' 31' ' ' VAL . 93.5 m-70 -69.34 -33.54 73.26 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.677 0.791 . . . . 0.0 111.776 -175.286 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.1 t-20 -51.32 -55.37 18.73 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 124.063 0.945 . . . . 0.0 111.446 175.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 5.6 tp -58.38 -45.7 87.79 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 114.889 -1.05 . . . . 0.0 112.187 170.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.66 -27.52 50.37 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.606 0.763 . . . . 0.0 112.785 178.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.452 HG23 ' O ' ' A' ' 27' ' ' HIS . 63.1 t -64.98 -51.14 70.43 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.029 0 C-N-CA 123.358 0.663 . . . . 0.0 110.417 175.348 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 4.7 t60 -61.57 -40.11 93.55 Favored 'General case' 0 N--CA 1.49 1.564 0 C-N-CA 123.382 0.673 . . . . 0.0 109.831 175.592 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.44 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 39.4 ttt180 -67.26 4.71 0.88 Allowed 'General case' 0 CA--C 1.558 1.279 0 CA-C-N 114.577 -1.192 . . . . 0.0 112.622 -176.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 25.5 ptt? -45.46 -17.35 0.03 OUTLIER 'General case' 0 N--CA 1.507 2.384 0 C-N-CA 125.708 1.603 . . . . 0.0 114.957 174.156 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.99 -59.69 2.63 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.43 0 C-N-CA 125.128 1.371 . . . . 0.0 109.213 176.233 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.44 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -102.05 9.35 40.43 Favored 'General case' 0 N--CA 1.504 2.231 0 C-N-CA 124.132 0.973 . . . . 0.0 112.98 -171.065 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 2.5 t -58.53 -56.39 22.7 Favored 'General case' 0 N--CA 1.488 1.455 0 C-N-CA 123.89 0.876 . . . . 0.0 113.247 -170.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 83.18 -32.07 3.08 Favored Glycine 0 CA--C 1.533 1.193 0 CA-C-O 119.835 -0.425 . . . . 0.0 112.544 -170.116 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -72.13 -37.27 69.49 Favored 'General case' 0 C--N 1.362 1.123 0 C-N-CA 123.729 0.812 . . . . 0.0 111.306 175.467 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 14.1 mptt 68.02 110.35 0.03 OUTLIER Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.927 1.291 . . . . 0.0 111.599 -170.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 84.3 Cg_endo -77.84 -164.65 0.28 Allowed 'Trans proline' 0 C--N 1.383 2.354 0 C-N-CA 122.551 2.167 . . . . 0.0 110.352 165.415 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 86.6 mt -117.12 104.25 11.04 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.233 0.613 . . . . 0.0 109.48 -177.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . 0.504 ' HA ' ' O ' ' A' ' 49' ' ' PHE . 24.3 tm0? -127.25 141.39 51.74 Favored 'General case' 0 CA--C 1.548 0.9 0 C-N-CA 123.682 0.793 . . . . 0.0 109.077 -168.095 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 3.2 t -69.49 107.98 3.59 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.612 0.765 . . . . 0.0 111.648 -178.934 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 14.9 pt-20 -55.93 -27.54 52.8 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.73 1.212 . . . . 0.0 113.312 177.699 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 42.1 mm -74.18 -57.51 6.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.817 0 C-N-CA 122.736 0.414 . . . . 0.0 109.919 -174.84 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.548 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.5 p -129.45 -88.44 0.51 Allowed 'General case' 0 CA--C 1.546 0.827 0 N-CA-C 109.566 -0.531 . . . . 0.0 109.566 -178.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.548 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -154.08 145.9 13.6 Favored Glycine 0 N--CA 1.448 -0.565 0 CA-C-O 116.997 -2.002 . . . . 0.0 108.781 -177.201 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.504 ' O ' ' HA ' ' A' ' 43' ' ' GLN . 20.1 t80 165.5 110.91 0.01 OUTLIER 'General case' 0 C--N 1.358 0.954 0 N-CA-C 102.302 -3.221 . . . . 0.0 102.302 166.988 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.2 m -118.85 136.3 54.1 Favored 'General case' 0 C--N 1.329 -0.296 0 N-CA-C 108.378 -0.971 . . . . 0.0 108.378 -174.536 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.526 ' SG ' HD22 ' A' ' 57' ' ' LEU . 25.7 p -157.33 -173.99 4.68 Favored 'General case' 0 C--N 1.31 -1.112 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.759 -176.513 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.474 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.75 13.38 7.43 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.739 0.815 . . . . 0.0 109.029 172.215 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.4 mt-30 -121.63 104.94 9.99 Favored 'General case' 0 C--N 1.352 0.69 0 C-N-CA 124.652 1.181 . . . . 0.0 108.303 -177.254 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 11.9 ptmm? -55.97 -31.78 63.31 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.439 1.096 . . . . 0.0 112.918 -177.014 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.03 -43.08 91.58 Favored 'General case' 0 N--CA 1.477 0.922 0 O-C-N 124.49 1.119 . . . . 0.0 111.903 174.503 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 9.6 t -61.25 -55.89 26.87 Favored 'General case' 0 CA--C 1.553 1.089 0 C-N-CA 123.452 0.701 . . . . 0.0 112.187 -171.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.526 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -75.4 -27.37 59.03 Favored 'General case' 0 N--CA 1.477 0.876 0 CA-C-O 119.26 -0.4 . . . . 0.0 111.576 178.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -50.21 -44.97 53.4 Favored 'General case' 0 N--CA 1.497 1.902 0 N-CA-C 112.656 0.613 . . . . 0.0 112.656 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 95.5 m95 -80.79 -37.77 29.66 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 122.358 -0.214 . . . . 0.0 110.596 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.409 ' HA ' ' HD3' ' A' ' 63' ' ' LYS . 83.1 t60 -48.5 -43.12 34.77 Favored 'General case' 0 CA--C 1.567 1.633 0 N-CA-C 114.056 1.132 . . . . 0.0 114.056 169.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.9 ptm -72.66 -33.84 66.84 Favored 'General case' 0 N--CA 1.498 1.928 0 CA-C-N 119.218 0.917 . . . . 0.0 112.285 172.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.3 -28.01 64.61 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 123.403 0.681 . . . . 0.0 111.183 168.1 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 60' ' ' HIS . 28.6 mtpp -72.39 -36.79 68.76 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.451 0.7 . . . . 0.0 110.364 173.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 68.6 m-70 -66.64 -24.73 66.34 Favored 'General case' 0 N--CA 1.491 1.598 0 C-N-CA 123.507 0.723 . . . . 0.0 111.437 177.026 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 36.3 t70 -56.08 -29.13 60.09 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.731 0.812 . . . . 0.0 112.578 -171.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -106.64 -54.17 2.51 Favored 'General case' 0 N--CA 1.474 0.733 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 167.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 32.4 t70 -51.56 -41.29 61.02 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 114.616 1.339 . . . . 0.0 114.616 -165.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 79.3 p -59.49 -69.62 0.2 Allowed 'General case' 0 CA--C 1.553 1.066 0 N-CA-C 112.751 0.649 . . . . 0.0 112.751 -172.886 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -138.43 -21.71 1.03 Allowed 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.951 0.9 . . . . 0.0 110.62 -176.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 45.2 m-85 -94.65 45.03 1.11 Allowed 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 124.58 1.152 . . . . 0.0 108.466 -170.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 36.4 tt0 -97.61 0.31 47.06 Favored 'General case' 0 N--CA 1.477 0.905 0 CA-C-N 114.44 -1.254 . . . . 0.0 110.948 -161.24 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.482 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 66.4 m-85 -137.03 136.95 38.88 Favored 'General case' 0 C--N 1.343 0.314 0 N-CA-C 107.198 -1.408 . . . . 0.0 107.198 -171.751 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 47.5 p -159.92 129.57 5.3 Favored 'General case' 0 C--N 1.315 -0.917 0 C-N-CA 124.435 1.094 . . . . 0.0 108.093 179.133 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.51 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 6.2 t -67.39 122.91 18.96 Favored 'General case' 0 C--N 1.32 -0.709 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 169.518 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 2.3 m-20 -53.51 -26.86 22.6 Favored 'General case' 0 N--CA 1.486 1.331 0 N-CA-C 113.409 0.892 . . . . 0.0 113.409 -174.665 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.41 HG21 HG21 ' A' ' 98' ' ' VAL . 7.8 mt -109.42 -25.94 3.41 Favored 'Isoleucine or valine' 0 CA--C 1.566 1.566 0 N-CA-C 113.538 0.94 . . . . 0.0 113.538 -171.814 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 14.9 p -140.37 5.23 2.04 Favored 'General case' 0 N--CA 1.506 2.361 0 CA-C-N 120.474 1.488 . . . . 0.0 113.258 178.899 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 51.88 42.86 54.27 Favored Glycine 0 N--CA 1.472 1.094 0 N-CA-C 114.695 0.638 . . . . 0.0 114.695 174.073 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.51 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 3.8 tmtp? -65.51 -39.01 91.34 Favored 'General case' 0 CA--C 1.567 1.623 0 N-CA-C 113.285 0.846 . . . . 0.0 113.285 -176.093 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.482 ' HG3' ' O ' ' A' ' 72' ' ' PHE . 0.0 OUTLIER 76.58 122.59 0.05 OUTLIER 'General case' 0 N--CA 1.499 1.99 0 C-N-CA 125.065 1.346 . . . . 0.0 111.408 -174.754 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.408 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 83.5 m-85 -135.68 148.62 48.99 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 125.123 1.369 . . . . 0.0 108.444 176.548 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.2 mm-40 -66.8 -19.27 65.71 Favored 'General case' 0 N--CA 1.481 1.096 0 N-CA-C 113.022 0.749 . . . . 0.0 113.022 -174.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.35 140.7 47.54 Favored 'General case' 0 C--O 1.246 0.88 0 C-N-CA 124.418 1.087 . . . . 0.0 108.14 177.846 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -58.88 -27.85 65.58 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.266 1.026 . . . . 0.0 110.653 175.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 26.2 t70 -56.88 -47.14 81.14 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 115.426 -0.806 . . . . 0.0 111.346 173.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 75.7 m -67.43 -27.68 67.26 Favored 'General case' 0 C--N 1.354 0.783 0 C-N-CA 122.431 0.292 . . . . 0.0 111.702 179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 61.1 t -71.22 -44.5 73.5 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.425 0.69 . . . . 0.0 110.098 -178.193 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 79.5 t -73.78 -38.18 50.28 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.824 0 C-N-CA 124.846 1.258 . . . . 0.0 109.592 -179.314 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -62.89 -40.01 96.23 Favored 'General case' 0 N--CA 1.479 0.975 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.521 177.809 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 7.7 t60 -73.32 -38.56 65.76 Favored 'General case' 0 C--O 1.211 -0.931 0 CA-C-N 114.463 -1.244 . . . . 0.0 111.073 178.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 6.3 ttpm? -72.57 -37.71 68.11 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 122.963 0.505 . . . . 0.0 110.947 -169.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -68.74 -30.39 69.0 Favored 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.365 -0.834 . . . . 0.0 111.103 176.323 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 37.4 ttmt -90.15 -46.31 8.54 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.835 0.854 . . . . 0.0 111.643 -171.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 42.4 t -88.16 -19.04 27.48 Favored 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 124.463 1.105 . . . . 0.0 110.652 -172.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 23.9 m-70 -139.52 59.21 13.61 Favored Pre-proline 0 CA--C 1.557 1.225 0 C-N-CA 123.649 0.78 . . . . 0.0 109.246 -176.615 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 19.6 Cg_endo -59.48 -40.17 69.09 Favored 'Trans proline' 0 C--N 1.38 2.214 0 C-N-CA 122.532 2.155 . . . . 0.0 112.875 -176.019 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -139.81 97.68 3.31 Favored 'General case' 0 C--N 1.353 0.733 0 C-N-CA 123.541 0.736 . . . . 0.0 110.178 176.259 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . 0.41 HG21 HG21 ' A' ' 76' ' ' ILE . 98.1 t . . . . . 0 N--CA 1.482 1.144 0 C-N-CA 124.031 0.932 . . . . 0.0 108.63 169.542 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 20.4 p-80 . . . . . 0 N--CA 1.488 1.444 0 CA-C-O 120.33 0.109 . . . . 0.0 111.259 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 13.5 tpt -152.05 99.56 2.55 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 123.878 0.871 . . . . 0.0 109.066 174.519 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -158.4 33.71 0.24 Allowed 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 107.444 -1.317 . . . . 0.0 107.444 177.61 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.508 ' HA ' ' HB1' ' A' ' 22' ' ' ALA . 15.8 m-20 -121.99 86.09 2.52 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 114.711 -1.131 . . . . 0.0 108.52 -162.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 87.5 m-85 -93.64 111.6 23.31 Favored 'General case' 0 C--O 1.24 0.564 0 CA-C-N 114.479 -1.237 . . . . 0.0 109.498 -178.22 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 20.7 mm -108.35 145.67 15.1 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.484 0 CA-C-N 114.53 -1.213 . . . . 0.0 109.558 -167.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.607 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 39.2 t -98.64 44.29 1.04 Allowed 'General case' 0 CA--C 1.547 0.849 0 N-CA-C 107.826 -1.176 . . . . 0.0 107.826 176.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 55.86 -40.53 0.03 OUTLIER 'General case' 0 N--CA 1.503 2.201 0 C-N-CA 128.226 2.61 . . . . 0.0 115.822 -172.373 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 5.4 t80 -134.94 -43.88 0.73 Allowed 'General case' 0 N--CA 1.466 0.333 0 C-N-CA 124.991 1.316 . . . . 0.0 109.414 -165.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 1.4 p -117.69 53.61 0.93 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.696 -172.081 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.607 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -154.22 127.49 8.46 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.992 158.444 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -58.44 3.94 Favored 'General case' 0 N--CA 1.483 1.189 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 171.737 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.508 ' HB1' ' HA ' ' A' ' 13' ' ' ASP . . . -170.47 127.37 0.79 Allowed 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.38 0.672 . . . . 0.0 110.867 164.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 57.2 m-85 -102.66 157.72 16.75 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.443 0.697 . . . . 0.0 109.13 171.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 40.2 ttpt -59.59 -36.08 75.55 Favored 'General case' 0 CA--C 1.546 0.809 0 CA-C-N 115.613 -0.722 . . . . 0.0 112.156 177.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 21.2 m -145.75 155.85 43.22 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-O 121.223 0.535 . . . . 0.0 111.068 -176.106 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 40.1 p -59.03 -34.51 71.99 Favored 'General case' 0 CA--C 1.553 1.09 0 CA-C-N 114.998 -1.001 . . . . 0.0 111.979 171.147 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 7.3 t60 -73.74 -33.16 64.21 Favored 'General case' 0 N--CA 1.485 1.283 0 C-N-CA 123.269 0.628 . . . . 0.0 110.601 175.813 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -62.15 -50.94 69.85 Favored 'General case' 0 N--CA 1.487 1.396 0 C-N-CA 123.958 0.903 . . . . 0.0 111.278 176.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.403 HD13 ' HB2' ' A' ' 16' ' ' CYS . 0.9 OUTLIER -63.49 -33.14 74.92 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.374 0.67 . . . . 0.0 111.406 176.235 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.467 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -53.75 -27.51 28.99 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 124.425 1.078 . . . . 0.0 112.198 176.965 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 89.6 t -64.61 -48.06 86.37 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.11 0 C-N-CA 123.864 0.865 . . . . 0.0 111.347 176.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -67.88 -37.84 82.28 Favored 'General case' 0 N--CA 1.485 1.287 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 176.17 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.638 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 52.4 ttt85 -62.64 -3.43 1.49 Allowed 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 125.718 1.607 . . . . 0.0 112.615 -177.436 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 20.8 ptt? -45.06 -16.19 0.02 OUTLIER 'General case' 0 N--CA 1.509 2.524 0 N-CA-C 115.502 1.667 . . . . 0.0 115.502 178.231 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 3.4 tp -85.51 -51.3 13.63 Favored 'Isoleucine or valine' 0 CA--C 1.57 1.733 0 C-N-CA 125.358 1.463 . . . . 0.0 110.027 177.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.638 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -104.6 11.71 33.9 Favored 'General case' 0 N--CA 1.508 2.472 0 C-N-CA 125.158 1.383 . . . . 0.0 112.996 -178.311 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.623 ' HA ' ' HG2' ' A' ' 33' ' ' ARG . 7.1 t -57.95 -55.05 39.88 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 115.36 1.615 . . . . 0.0 115.36 -161.193 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.05 36.69 91.08 Favored Glycine 0 N--CA 1.473 1.164 0 N-CA-C 112.025 -0.43 . . . . 0.0 112.025 -171.982 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.401 ' HB2' ' OG1' ' A' ' 37' ' ' THR . 33.7 mt-10 -158.82 -58.46 0.07 Allowed 'General case' 0 N--CA 1.489 1.517 0 N-CA-C 106.907 -1.516 . . . . 0.0 106.907 -168.641 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 36.0 mtmm 76.58 97.45 0.04 OUTLIER Pre-proline 0 C--N 1.352 0.708 0 C-N-CA 126.824 2.05 . . . . 0.0 111.504 -179.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -69.33 172.16 12.71 Favored 'Trans proline' 0 C--N 1.385 2.469 0 C-N-CA 122.508 2.139 . . . . 0.0 110.915 164.481 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.1 mt -89.34 138.51 31.37 Favored 'General case' 0 N--CA 1.465 0.324 0 N-CA-C 109.313 -0.625 . . . . 0.0 109.313 -169.932 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 52.6 tt0 -139.39 136.79 35.08 Favored 'General case' 0 CA--C 1.535 0.375 0 O-C-N 123.242 0.339 . . . . 0.0 110.277 -171.389 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.548 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 3.9 t -70.56 106.39 3.45 Favored 'General case' 0 N--CA 1.466 0.367 0 C-N-CA 123.875 0.87 . . . . 0.0 109.433 175.85 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 38.1 mt-10 -80.33 16.65 1.23 Allowed 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.834 0.854 . . . . 0.0 112.646 -178.308 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.548 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 3.5 mp -94.53 -56.02 5.59 Favored 'Isoleucine or valine' 0 C--N 1.351 0.656 0 N-CA-C 106.789 -1.56 . . . . 0.0 106.789 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.515 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 23.7 p -116.32 -108.38 0.37 Allowed 'General case' 0 C--O 1.24 0.571 0 N-CA-C 104.206 -2.516 . . . . 0.0 104.206 172.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.515 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -149.09 159.85 28.19 Favored Glycine 0 CA--C 1.525 0.664 0 N-CA-C 108.593 -1.803 . . . . 0.0 108.593 155.773 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.479 ' HB3' ' HB3' ' A' ' 44' ' ' CYS . 15.4 t80 174.08 111.16 0.02 OUTLIER 'General case' 0 C--N 1.353 0.737 0 N-CA-C 102.617 -3.105 . . . . 0.0 102.617 -179.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 5.0 m -119.73 135.25 54.92 Favored 'General case' 0 C--N 1.321 -0.635 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 -171.54 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 48.8 t -157.31 157.96 35.14 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 114.935 -1.03 . . . . 0.0 110.728 178.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.476 ' HD2' ' N ' ' A' ' 53' ' ' GLN . 2.2 ppt_? -78.47 -21.82 48.47 Favored 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 114.526 -1.215 . . . . 0.0 111.677 176.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.476 ' N ' ' HD2' ' A' ' 52' ' ' ARG . 8.0 tp60 -98.62 115.84 29.52 Favored 'General case' 0 C--O 1.236 0.369 0 N-CA-C 108.153 -1.054 . . . . 0.0 108.153 -174.87 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -55.22 -34.27 63.8 Favored 'General case' 0 N--CA 1.481 1.123 0 N-CA-C 112.646 0.61 . . . . 0.0 112.646 176.535 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -54.98 -41.43 71.19 Favored 'General case' 0 N--CA 1.481 1.081 0 O-C-N 124.266 0.979 . . . . 0.0 111.85 175.886 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 33.2 m -57.42 -56.48 21.31 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 123.274 0.63 . . . . 0.0 112.174 -174.025 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.568 HD23 ' H ' ' A' ' 57' ' ' LEU . 2.2 pt? -76.29 -27.62 56.7 Favored 'General case' 0 CA--C 1.546 0.79 0 C-N-CA 123.048 0.539 . . . . 0.0 111.969 177.763 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 6.1 t30 -50.4 -46.79 56.47 Favored 'General case' 0 N--CA 1.501 2.084 0 C-N-CA 123.616 0.766 . . . . 0.0 112.59 173.679 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 91.1 m95 -81.02 -46.06 15.62 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 109.473 -0.565 . . . . 0.0 109.473 179.21 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.542 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 78.6 t60 -45.53 -43.09 11.59 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 115.321 1.6 . . . . 0.0 115.321 176.266 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 25.6 ptm -63.1 -39.76 95.64 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-N 118.667 0.667 . . . . 0.0 111.459 175.131 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -68.86 -24.92 64.4 Favored 'General case' 0 CA--C 1.556 1.206 0 C-N-CA 122.827 0.451 . . . . 0.0 111.625 175.216 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.477 ' HD2' ' CD1' ' A' ' 69' ' ' PHE . 73.6 mmtt -63.3 -29.95 71.18 Favored 'General case' 0 N--CA 1.489 1.497 0 C-N-CA 122.5 0.32 . . . . 0.0 110.693 171.857 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 64.3 m-70 -70.62 -8.33 50.91 Favored 'General case' 0 N--CA 1.494 1.746 0 C-N-CA 124.083 0.953 . . . . 0.0 112.106 178.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 9.6 t70 -60.57 -53.33 58.8 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.064 0.545 . . . . 0.0 110.027 -179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -107.14 -12.54 15.37 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.587 0.755 . . . . 0.0 111.761 174.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 55.9 43.83 26.81 Favored 'General case' 0 N--CA 1.498 1.95 0 C-N-CA 124.103 0.961 . . . . 0.0 110.258 -170.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 24.9 p -72.05 -63.95 1.04 Allowed 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 114.596 -1.184 . . . . 0.0 111.103 -169.888 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . 0.542 ' HD2' ' HB3' ' A' ' 80' ' ' LYS . 92.1 m-85 -65.18 -6.14 8.59 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 113.324 0.861 . . . . 0.0 113.324 -179.031 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 7.6 m-85 -71.34 -34.38 70.45 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.746 0.818 . . . . 0.0 110.298 168.573 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 16.2 mm-40 -113.16 12.17 18.99 Favored 'General case' 0 N--CA 1.471 0.615 0 C-N-CA 124.635 1.174 . . . . 0.0 111.481 -173.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.43 ' CE2' ' HG3' ' A' ' 84' ' ' LYS . 23.6 m-85 -135.17 135.3 40.95 Favored 'General case' 0 N--CA 1.478 0.944 0 N-CA-C 107.922 -1.14 . . . . 0.0 107.922 179.811 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 67.7 m -156.57 167.21 31.13 Favored 'General case' 0 N--CA 1.473 0.676 0 C-N-CA 124.917 1.287 . . . . 0.0 109.91 178.271 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.414 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 36.2 t -96.68 124.09 40.56 Favored 'General case' 0 CA--C 1.533 0.297 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 162.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . 0.406 ' OD1' HG13 ' A' ' 76' ' ' ILE . 14.7 p30 -62.45 -20.42 64.52 Favored 'General case' 0 N--CA 1.481 1.099 0 N-CA-C 113.378 0.881 . . . . 0.0 113.378 179.995 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . 0.406 HG13 ' OD1' ' A' ' 75' ' ' ASN . 7.2 mt -104.11 -37.05 4.24 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.207 0 N-CA-C 112.989 0.737 . . . . 0.0 112.989 -175.912 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 21.8 p -134.62 13.09 3.74 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-N 119.62 1.1 . . . . 0.0 113.007 -177.128 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 50.36 32.83 23.04 Favored Glycine 0 C--N 1.358 1.753 0 N-CA-C 114.762 0.665 . . . . 0.0 114.762 171.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.414 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 8.3 tmtm? -63.69 -35.17 79.69 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 123.889 0.876 . . . . 0.0 112.57 -174.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.542 ' HB3' ' HD2' ' A' ' 69' ' ' PHE . 4.8 mptp? 75.09 115.61 0.06 Allowed 'General case' 0 N--CA 1.491 1.586 0 C-N-CA 124.384 1.074 . . . . 0.0 109.948 -179.175 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.405 ' CD1' HG22 ' A' ' 87' ' ' VAL . 96.2 m-85 -124.22 154.6 39.92 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.769 0.827 . . . . 0.0 111.475 -177.458 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 42.8 tt0 -62.43 -41.26 98.58 Favored 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 124.434 1.094 . . . . 0.0 111.354 172.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.549 ' HB2' ' H ' ' A' ' 86' ' ' SER . 35.4 mtpt -121.61 144.59 48.66 Favored 'General case' 0 C--N 1.348 0.522 0 C-N-CA 123.823 0.849 . . . . 0.0 108.747 -173.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . 0.43 ' HG3' ' CE2' ' A' ' 72' ' ' PHE . 52.3 mtmt -65.03 -31.21 72.33 Favored 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 108.773 -0.825 . . . . 0.0 108.773 166.091 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . 0.424 ' HB3' ' HE2' ' A' ' 83' ' ' LYS . 33.1 t70 -54.61 -46.0 73.76 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 124.387 1.075 . . . . 0.0 110.578 170.047 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.549 ' H ' ' HB2' ' A' ' 83' ' ' LYS . 19.7 m -62.53 -32.44 73.38 Favored 'General case' 0 CA--C 1.551 1.004 0 O-C-N 123.336 0.397 . . . . 0.0 111.993 176.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . 0.405 HG22 ' CD1' ' A' ' 81' ' ' PHE . 45.2 t -74.62 -45.03 46.12 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.334 0 C-N-CA 123.128 0.571 . . . . 0.0 110.113 -175.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . 0.412 HG23 ' O ' ' A' ' 84' ' ' LYS . 99.3 t -70.92 -37.69 69.22 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 124.45 1.1 . . . . 0.0 109.29 -175.099 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -68.14 -38.43 82.16 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 114.673 -1.148 . . . . 0.0 109.511 177.302 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 10.1 t60 -73.06 -33.83 65.89 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 115.026 -0.988 . . . . 0.0 111.603 178.797 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 58.4 tttm -73.69 -45.75 50.45 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.199 0.599 . . . . 0.0 110.35 -175.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -66.11 -21.0 66.33 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.672 0.789 . . . . 0.0 111.825 178.791 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 33.4 ttpt -100.28 -49.96 4.1 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.995 0.918 . . . . 0.0 111.982 -175.217 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 28.6 t -99.81 -4.35 30.7 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 124.189 0.996 . . . . 0.0 111.427 -168.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . 0.417 ' N ' ' HD3' ' A' ' 96' ' ' PRO . 54.0 m-70 -137.91 55.18 8.67 Favored Pre-proline 0 CA--C 1.568 1.651 0 C-N-CA 124.05 0.94 . . . . 0.0 110.804 179.681 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . 0.417 ' HD3' ' N ' ' A' ' 95' ' ' HIS . 75.0 Cg_exo -54.78 -45.74 38.65 Favored 'Trans proline' 0 C--N 1.39 2.741 0 C-N-CA 123.161 2.574 . . . . 0.0 113.27 174.998 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -137.87 97.41 3.42 Favored 'General case' 0 C--N 1.351 0.66 0 C-N-CA 124.024 0.93 . . . . 0.0 109.737 -178.283 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.9 p . . . . . 0 CA--C 1.56 1.34 0 C-N-CA 124.755 1.222 . . . . 0.0 109.599 172.251 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 40.1 m80 . . . . . 0 N--CA 1.482 1.156 0 N-CA-C 109.714 -0.476 . . . . 0.0 109.714 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 71.9 mtm -114.1 129.84 56.6 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.556 0.743 . . . . 0.0 109.873 179.86 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 29.9 ttm180 -89.49 16.38 7.75 Favored 'General case' 0 N--CA 1.485 1.296 0 CA-C-O 122.219 1.009 . . . . 0.0 109.803 174.731 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.502 ' HB3' ' HB1' ' A' ' 22' ' ' ALA . 4.7 m-20 -134.72 93.72 3.07 Favored 'General case' 0 C--O 1.235 0.319 0 C-N-CA 124.704 1.202 . . . . 0.0 108.362 -167.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 70.7 m-85 -79.36 113.59 17.62 Favored 'General case' 0 C--N 1.323 -0.553 0 C-N-CA 125.244 1.418 . . . . 0.0 109.948 177.406 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 28.8 mt -109.6 134.04 52.93 Favored 'Isoleucine or valine' 0 C--O 1.238 0.491 0 C-N-CA 123.585 0.754 . . . . 0.0 110.338 -175.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.485 ' H ' ' HB3' ' A' ' 20' ' ' ALA . 9.9 t -80.16 103.01 9.74 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 105.529 -2.026 . . . . 0.0 105.529 159.813 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -57.97 -15.01 7.47 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 124.613 1.165 . . . . 0.0 112.834 -168.16 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 22.8 m-85 -106.93 -40.16 5.55 Favored 'General case' 0 C--O 1.237 0.423 0 C-N-CA 123.005 0.522 . . . . 0.0 110.485 -171.385 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -141.8 48.84 1.6 Allowed 'General case' 0 N--CA 1.473 0.691 0 CA-C-N 115.756 -0.656 . . . . 0.0 112.356 -178.798 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . 0.485 ' HB3' ' H ' ' A' ' 16' ' ' CYS . . . -155.54 148.28 24.21 Favored 'General case' 0 N--CA 1.475 0.823 0 N-CA-C 112.664 0.616 . . . . 0.0 112.664 163.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . 0.415 ' HG3' ' H ' ' A' ' 22' ' ' ALA . 10.5 ptp180 -71.86 -72.49 0.22 Allowed 'General case' 0 CA--C 1.557 1.243 0 CA-C-N 114.236 -1.347 . . . . 0.0 110.785 168.894 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . 0.502 ' HB1' ' HB3' ' A' ' 13' ' ' ASP . . . -171.15 154.63 4.1 Favored 'General case' 0 N--CA 1.486 1.371 0 C-N-CA 124.234 1.013 . . . . 0.0 109.696 172.046 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -131.72 143.14 50.05 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 123.523 0.729 . . . . 0.0 109.335 176.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 14.6 ptmm? -72.17 -7.67 50.44 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 112.729 0.64 . . . . 0.0 112.729 -175.463 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 54.7 m -149.9 152.85 35.7 Favored 'General case' 0 CA--C 1.553 1.067 0 C-N-CA 123.231 0.612 . . . . 0.0 110.395 178.003 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 13.0 t -61.5 -34.39 75.43 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 123.7 0.8 . . . . 0.0 111.726 174.238 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 35.8 t60 -73.28 -37.62 66.19 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 122.766 0.426 . . . . 0.0 110.788 176.129 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 2.5 t-20 -56.59 -46.99 80.52 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.953 0.883 . . . . 0.0 109.927 173.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 1.9 tp -62.43 -39.12 92.27 Favored 'General case' 0 C--O 1.217 -0.638 0 CA-C-N 114.27 -1.332 . . . . 0.0 112.592 171.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.571 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -54.33 -28.31 41.79 Favored 'General case' 0 N--CA 1.494 1.758 0 C-N-CA 123.704 0.802 . . . . 0.0 112.496 176.529 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 85.0 t -63.73 -43.73 98.11 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 C-N-CA 124.11 0.964 . . . . 0.0 111.185 176.089 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 17.8 t60 -70.5 -44.46 67.59 Favored 'General case' 0 N--CA 1.483 1.204 0 CA-C-O 121.685 0.755 . . . . 0.0 110.391 170.339 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.571 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 49.7 ttp180 -70.87 4.43 2.58 Favored 'General case' 0 C--O 1.202 -1.404 0 C-N-CA 125.234 1.414 . . . . 0.0 111.059 -171.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . 0.422 ' O ' HG21 ' A' ' 50' ' ' THR . 19.8 ptt? -44.82 -20.4 0.04 OUTLIER 'General case' 0 CA--C 1.567 1.624 0 C-N-CA 125.184 1.394 . . . . 0.0 114.079 170.976 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 0.9 OUTLIER -85.27 -47.13 17.08 Favored 'Isoleucine or valine' 0 CA--C 1.562 1.414 0 C-N-CA 125.434 1.494 . . . . 0.0 109.346 178.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -101.19 -11.34 19.61 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 112.746 0.647 . . . . 0.0 112.746 -172.94 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . 0.464 ' HB ' ' O ' ' A' ' 33' ' ' ARG . 4.5 t -60.1 -41.88 93.49 Favored 'General case' 0 N--CA 1.491 1.594 0 N-CA-C 114.864 1.431 . . . . 0.0 114.864 -152.277 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 67.8 39.6 89.87 Favored Glycine 0 C--N 1.347 1.17 0 C-N-CA 121.304 -0.474 . . . . 0.0 112.646 -178.604 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -131.6 -80.74 0.52 Allowed 'General case' 0 N--CA 1.481 1.1 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -171.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 15.4 ptpt 164.05 93.54 0.02 OUTLIER Pre-proline 0 N--CA 1.487 1.419 0 C-N-CA 126.336 1.854 . . . . 0.0 109.231 -177.002 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 18.9 Cg_endo -97.13 -155.01 0.04 OUTLIER 'Trans proline' 0 C--N 1.374 1.896 0 C-N-CA 124.044 3.162 . . . . 0.0 111.08 173.599 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 68.3 mt -93.28 83.25 4.58 Favored 'General case' 0 N--CA 1.475 0.799 0 N-CA-C 107.041 -1.466 . . . . 0.0 107.041 172.418 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -118.97 136.06 54.29 Favored 'General case' 0 C--O 1.241 0.656 0 CA-C-N 115.83 -0.623 . . . . 0.0 109.745 -171.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.723 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 8.3 t -68.95 106.72 2.84 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 115.45 -0.796 . . . . 0.0 109.166 170.411 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.9 tp10 -93.6 53.43 1.86 Allowed 'General case' 0 CA--C 1.545 0.771 0 CA-C-O 122.645 1.212 . . . . 0.0 108.056 179.234 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.723 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 47.7 mm -134.28 -7.14 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.206 0 C-N-CA 125.938 1.695 . . . . 0.0 108.978 -176.716 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.539 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 13.1 p -178.68 -118.09 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.434 0 N-CA-C 103.733 -2.691 . . . . 0.0 103.733 -168.158 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.539 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -150.69 134.68 4.84 Favored Glycine 0 C--N 1.308 -0.975 0 N-CA-C 107.99 -2.044 . . . . 0.0 107.99 161.347 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 43.8 t80 178.1 117.99 0.04 OUTLIER 'General case' 0 C--N 1.351 0.653 0 N-CA-C 102.481 -3.155 . . . . 0.0 102.481 179.541 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . 0.422 HG21 ' O ' ' A' ' 34' ' ' MET . 6.8 m -124.57 147.4 48.47 Favored 'General case' 0 C--N 1.319 -0.733 0 CA-C-N 119.213 0.915 . . . . 0.0 110.141 -176.496 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.532 ' SG ' HD22 ' A' ' 57' ' ' LEU . 16.2 p -148.9 179.14 8.08 Favored 'General case' 0 C--N 1.316 -0.884 0 CA-C-N 113.888 -1.505 . . . . 0.0 110.016 176.088 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . 0.526 ' H ' ' HD3' ' A' ' 52' ' ' ARG . 0.0 OUTLIER -126.35 23.4 6.96 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 125.135 1.374 . . . . 0.0 108.142 177.293 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -146.52 118.2 8.07 Favored 'General case' 0 N--CA 1.472 0.636 0 CA-C-N 114.073 -1.421 . . . . 0.0 108.298 -167.087 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -53.83 -47.22 71.14 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.494 1.118 . . . . 0.0 113.094 -175.675 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -59.36 -33.25 70.94 Favored 'General case' 0 N--CA 1.482 1.162 0 N-CA-C 113.075 0.769 . . . . 0.0 113.075 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 43.0 m -63.65 -55.42 23.69 Favored 'General case' 0 CA--C 1.554 1.109 0 N-CA-C 112.481 0.548 . . . . 0.0 112.481 -176.865 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.532 HD22 ' SG ' ' A' ' 51' ' ' CYS . 2.6 pt? -76.72 -26.35 54.55 Favored 'General case' 0 C--N 1.357 0.9 0 CA-C-N 118.09 0.405 . . . . 0.0 111.33 176.812 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 7.4 t30 -55.58 -49.61 72.28 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 113.541 0.941 . . . . 0.0 113.541 173.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 12.0 p-90 -79.19 -33.38 43.93 Favored 'General case' 0 N--CA 1.482 1.14 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 -177.367 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.517 ' O ' ' HB2' ' A' ' 63' ' ' LYS . 85.9 t60 -54.79 -38.51 67.39 Favored 'General case' 0 CA--C 1.569 1.699 0 N-CA-C 114.958 1.466 . . . . 0.0 114.958 167.096 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -74.2 -31.25 62.57 Favored 'General case' 0 N--CA 1.494 1.769 0 CA-C-N 120.127 1.33 . . . . 0.0 110.268 174.198 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . 0.528 ' HA ' ' HB3' ' A' ' 65' ' ' ASP . 26.2 ttpp -61.21 -27.78 68.68 Favored 'General case' 0 CA--C 1.56 1.338 0 C-N-CA 123.411 0.684 . . . . 0.0 111.709 167.538 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.517 ' HB2' ' O ' ' A' ' 60' ' ' HIS . 6.4 mmpt? -63.3 -44.64 94.44 Favored 'General case' 0 N--CA 1.493 1.694 0 C-N-CA 123.155 0.582 . . . . 0.0 110.864 169.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . . . . . . . . . 96.1 m-70 -66.4 -30.8 71.25 Favored 'General case' 0 N--CA 1.491 1.599 0 C-N-CA 123.306 0.643 . . . . 0.0 111.107 172.112 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . 0.528 ' HB3' ' HA ' ' A' ' 62' ' ' LYS . 22.4 t70 -79.82 -21.63 44.0 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.848 0.859 . . . . 0.0 109.09 -177.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.01 -36.3 75.01 Favored 'General case' 0 C--N 1.35 0.624 0 C-N-CA 123.938 0.895 . . . . 0.0 110.736 176.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 16.8 t70 81.73 -35.48 0.1 Allowed 'General case' 0 N--CA 1.491 1.611 0 C-N-CA 124.902 1.281 . . . . 0.0 111.479 174.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 14.8 p -70.24 -37.79 75.06 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 124.57 1.148 . . . . 0.0 111.645 -178.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -61.82 -43.29 99.14 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 123.351 0.66 . . . . 0.0 110.629 175.327 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 15.1 t80 -94.62 65.09 3.09 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-O 122.198 0.999 . . . . 0.0 110.478 -172.916 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 79.2 mt-30 -99.37 -37.91 9.04 Favored 'General case' 0 N--CA 1.47 0.562 0 CA-C-N 114.937 -1.029 . . . . 0.0 108.292 169.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . 0.439 ' O ' ' HG3' ' A' ' 80' ' ' LYS . 43.2 m-85 -148.77 133.9 18.26 Favored 'General case' 0 C--N 1.347 0.49 0 N-CA-C 105.083 -2.191 . . . . 0.0 105.083 179.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 39.4 t -163.02 131.19 3.79 Favored 'General case' 0 C--N 1.312 -1.059 0 C-N-CA 124.392 1.077 . . . . 0.0 108.292 174.152 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . 0.451 ' HB3' ' H ' ' A' ' 79' ' ' LYS . 17.5 t -72.61 122.35 21.25 Favored 'General case' 0 C--N 1.323 -0.558 0 N-CA-C 107.699 -1.223 . . . . 0.0 107.699 165.442 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 20.4 p-10 -57.5 -27.04 62.19 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.186 0.994 . . . . 0.0 112.33 -179.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 17.1 mt -94.84 -51.52 10.78 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.995 0 C-N-CA 123.555 0.742 . . . . 0.0 111.558 -174.925 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.0 p -128.82 11.24 6.1 Favored 'General case' 0 N--CA 1.492 1.627 0 CA-C-N 119.455 1.025 . . . . 0.0 112.724 -172.494 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 48.81 41.69 28.07 Favored Glycine 0 C--N 1.36 1.888 0 N-CA-C 114.68 0.632 . . . . 0.0 114.68 172.019 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.451 ' H ' ' HB3' ' A' ' 74' ' ' CYS . 6.4 tmtm? -66.02 -41.83 90.46 Favored 'General case' 0 CA--C 1.565 1.546 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -177.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.439 ' HG3' ' O ' ' A' ' 72' ' ' PHE . 12.4 mptt 72.77 121.57 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.718 0 C-N-CA 124.85 1.26 . . . . 0.0 110.771 -176.236 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . . . . . . . . . 77.0 m-85 -126.39 162.75 24.83 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.242 1.017 . . . . 0.0 111.378 -178.448 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 13.0 mm-40 -69.19 -18.73 63.95 Favored 'General case' 0 N--CA 1.482 1.157 0 N-CA-C 113.28 0.844 . . . . 0.0 113.28 -177.472 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.447 ' HG3' ' H ' ' A' ' 86' ' ' SER . 26.0 pttm -147.32 148.63 31.58 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 108.02 -1.104 . . . . 0.0 108.02 174.954 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -64.44 -25.22 67.91 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.326 0.65 . . . . 0.0 110.759 -179.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 38.2 t70 -61.29 -38.11 85.64 Favored 'General case' 0 N--CA 1.473 0.696 0 C-N-CA 123.349 0.66 . . . . 0.0 110.76 173.483 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.447 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 70.8 m -68.98 -30.0 68.33 Favored 'General case' 0 CA--C 1.547 0.857 0 C-N-CA 122.83 0.452 . . . . 0.0 111.1 176.872 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 93.7 t -72.39 -44.32 62.84 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.34 0 C-N-CA 123.475 0.71 . . . . 0.0 109.999 -176.592 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 68.1 t -72.27 -37.86 60.05 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.875 0 CA-C-N 114.447 -1.252 . . . . 0.0 109.295 -179.205 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.08 -37.3 85.46 Favored 'General case' 0 C--N 1.35 0.601 0 CA-C-N 115.12 -0.946 . . . . 0.0 109.615 176.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 11.7 t60 -71.7 -31.63 66.96 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 124.068 0.947 . . . . 0.0 111.245 179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttpt -71.47 -37.66 71.32 Favored 'General case' 0 N--CA 1.474 0.767 0 CA-C-O 121.58 0.705 . . . . 0.0 109.103 178.724 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -73.62 -27.47 61.29 Favored 'General case' 0 CA--C 1.547 0.838 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.548 176.214 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 28.5 tptp -88.38 -52.36 5.24 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 124.066 0.946 . . . . 0.0 111.183 -174.722 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 32.9 t -97.32 -16.49 20.26 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.053 0.941 . . . . 0.0 110.983 -167.282 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 30.1 m-70 -134.97 37.01 0.34 Allowed Pre-proline 0 CA--C 1.571 1.771 0 CA-C-O 118.029 -0.986 . . . . 0.0 113.038 -177.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 42.7 Cg_endo -66.86 -33.3 34.04 Favored 'Trans proline' 0 C--N 1.394 2.963 0 CA-C-N 121.768 1.667 . . . . 0.0 112.541 -170.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -134.38 94.8 3.27 Favored 'General case' 0 C--N 1.351 0.642 0 N-CA-C 106.8 -1.555 . . . . 0.0 106.8 171.872 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 4.3 p . . . . . 0 CA--C 1.56 1.358 0 CA-C-O 117.735 -1.126 . . . . 0.0 109.155 179.653 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.7 p80 . . . . . 0 N--CA 1.479 0.987 0 CA-C-O 120.64 0.257 . . . . 0.0 110.535 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 61.0 mtt -85.39 88.12 7.47 Favored 'General case' 0 N--CA 1.483 1.203 0 N-CA-C 109.323 -0.621 . . . . 0.0 109.323 175.614 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 40.6 ttm180 -164.75 41.9 0.08 Allowed 'General case' 0 N--CA 1.479 1.0 0 CA-C-O 121.746 0.784 . . . . 0.0 108.949 -177.14 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -132.38 84.28 2.14 Favored 'General case' 0 N--CA 1.473 0.723 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 -170.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 75.6 m-85 -95.96 118.0 31.73 Favored 'General case' 0 C--N 1.321 -0.633 0 C-N-CA 124.989 1.315 . . . . 0.0 109.074 -177.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . 0.555 HG22 ' H ' ' A' ' 17' ' ' GLU . 14.7 mm -125.29 156.61 34.45 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 N-CA-C 108.305 -0.998 . . . . 0.0 108.305 -169.249 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . 0.499 ' HB2' HD11 ' A' ' 29' ' ' LEU . 28.5 t -91.31 12.37 20.61 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.867 0.867 . . . . 0.0 110.285 175.114 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.555 ' H ' HG22 ' A' ' 15' ' ' ILE . 4.8 mp0 88.21 -38.22 0.03 OUTLIER 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 126.9 2.08 . . . . 0.0 110.705 169.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 13.0 t80 -139.17 -52.94 0.56 Allowed 'General case' 0 N--CA 1.474 0.73 0 CA-C-O 121.379 0.609 . . . . 0.0 109.993 -177.59 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 5.8 p -98.52 70.5 1.96 Allowed 'General case' 0 N--CA 1.477 0.889 0 CA-C-N 115.209 -0.905 . . . . 0.0 111.218 178.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -148.97 -172.63 4.16 Favored 'General case' 0 N--CA 1.48 1.047 0 N-CA-C 112.357 0.503 . . . . 0.0 112.357 163.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -112.57 -104.5 0.39 Allowed 'General case' 0 CA--C 1.556 1.197 0 N-CA-C 105.868 -1.901 . . . . 0.0 105.868 175.163 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -144.76 134.05 22.99 Favored 'General case' 0 N--CA 1.477 0.91 0 N-CA-C 108.241 -1.022 . . . . 0.0 108.241 161.941 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 85.8 m-85 -118.26 165.33 13.96 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.572 0.749 . . . . 0.0 109.576 175.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 57.1 pttt -103.06 10.33 38.08 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.747 0.819 . . . . 0.0 111.045 177.405 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 13.6 t -169.01 139.74 2.36 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.056 0.943 . . . . 0.0 109.936 -174.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . . . . . . . . . 51.8 p -73.61 -37.47 65.39 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.182 0.993 . . . . 0.0 110.956 178.479 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . . . . . . . . . 89.1 m-70 -70.35 -35.13 73.37 Favored 'General case' 0 N--CA 1.476 0.828 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.526 177.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . 0.455 ' O ' HG22 ' A' ' 31' ' ' VAL . 55.6 t30 -59.12 -54.18 49.9 Favored 'General case' 0 N--CA 1.484 1.23 0 CA-C-O 121.456 0.646 . . . . 0.0 109.97 170.563 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.499 HD11 ' HB2' ' A' ' 16' ' ' CYS . 0.2 OUTLIER -54.66 -30.05 54.2 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 125.46 1.504 . . . . 0.0 112.439 178.239 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.71 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . . . -52.71 -24.29 8.37 Favored 'General case' 0 N--CA 1.485 1.308 0 N-CA-C 113.818 1.044 . . . . 0.0 113.818 175.675 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.455 HG22 ' O ' ' A' ' 28' ' ' ASN . 32.5 m -53.47 -49.12 56.28 Favored 'Isoleucine or valine' 0 CA--C 1.559 1.313 0 N-CA-C 111.996 0.369 . . . . 0.0 111.996 170.929 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 7.9 t60 -74.94 -46.8 33.19 Favored 'General case' 0 N--CA 1.476 0.833 0 CA-C-O 121.594 0.711 . . . . 0.0 109.273 172.533 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.71 ' HB3' ' HA ' ' A' ' 30' ' ' ALA . 19.2 ttt180 -76.82 41.87 0.29 Allowed 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 125.615 1.566 . . . . 0.0 109.428 -173.543 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 5.1 ppp? -66.79 -57.26 7.42 Favored 'General case' 0 C--N 1.359 0.993 0 CA-C-O 118.821 -0.609 . . . . 0.0 111.188 -163.302 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 9.4 tp -68.27 -26.98 35.26 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.979 0 N-CA-C 116.902 2.186 . . . . 0.0 116.902 168.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.568 ' HD2' ' HA ' ' A' ' 33' ' ' ARG . 43.1 m-70 -79.45 -34.86 41.17 Favored 'General case' 0 N--CA 1.498 1.963 0 CA-C-N 121.094 1.77 . . . . 0.0 108.736 -158.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 10.1 t -70.55 -36.58 73.74 Favored 'General case' 0 N--CA 1.481 1.124 0 CA-C-N 114.965 -1.016 . . . . 0.0 113.268 -166.82 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 103.04 -30.71 9.84 Favored Glycine 0 CA--C 1.53 1.023 0 CA-C-O 119.734 -0.481 . . . . 0.0 112.339 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -46.38 -39.07 9.79 Favored 'General case' 0 N--CA 1.49 1.559 0 C-N-CA 124.812 1.245 . . . . 0.0 114.027 170.518 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 64.9 mttm 58.39 87.37 0.14 Allowed Pre-proline 0 CA--C 1.555 1.136 0 C-N-CA 124.549 1.14 . . . . 0.0 111.535 -177.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 64.6 Cg_endo -72.46 -179.48 4.12 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.097 1.865 . . . . 0.0 111.276 166.887 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.7 mt -111.92 130.72 55.75 Favored 'General case' 0 N--CA 1.471 0.606 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 -178.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -111.93 138.03 49.11 Favored 'General case' 0 C--O 1.236 0.375 0 C-N-CA 123.174 0.59 . . . . 0.0 109.952 -174.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.447 ' SG ' ' HG2' ' A' ' 61' ' ' MET . 3.5 t -63.31 116.9 5.91 Favored 'General case' 0 N--CA 1.471 0.618 0 C-N-CA 124.05 0.94 . . . . 0.0 110.231 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 39.9 mt-10 -79.08 33.04 0.22 Allowed 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 124.945 1.298 . . . . 0.0 112.356 -171.911 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.9 mm -133.66 -7.0 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.344 0 C-N-CA 125.074 1.349 . . . . 0.0 108.679 -172.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.536 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 0.8 OUTLIER 174.05 -139.39 0.0 OUTLIER 'General case' 0 CA--C 1.544 0.748 0 N-CA-C 104.285 -2.487 . . . . 0.0 104.285 -160.593 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.536 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -143.46 135.9 6.65 Favored Glycine 0 N--CA 1.467 0.739 0 N-CA-C 108.22 -1.952 . . . . 0.0 108.22 172.162 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 31.5 t80 179.12 115.23 0.04 OUTLIER 'General case' 0 C--N 1.348 0.54 0 N-CA-C 102.614 -3.106 . . . . 0.0 102.614 -172.27 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -115.65 130.29 56.81 Favored 'General case' 0 C--N 1.316 -0.886 0 C-N-CA 122.765 0.426 . . . . 0.0 110.255 -166.828 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . 0.637 ' SG ' ' HB2' ' A' ' 56' ' ' SER . 42.8 t -149.03 151.63 34.86 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-N 114.997 -1.001 . . . . 0.0 110.281 -179.245 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 15.1 mmt85 -80.49 -30.34 37.37 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 123.94 0.896 . . . . 0.0 110.422 179.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 23.2 mt-30 -92.5 111.32 22.86 Favored 'General case' 0 C--O 1.237 0.437 0 C-N-CA 124.323 1.049 . . . . 0.0 109.12 -176.273 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 21.4 pttp -53.7 -35.22 60.9 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.59 1.156 . . . . 0.0 112.891 -175.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . . . . . . . . . . . -63.01 -48.69 77.73 Favored 'General case' 0 CA--C 1.549 0.94 0 O-C-N 123.965 0.791 . . . . 0.0 111.634 175.568 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . 0.637 ' HB2' ' SG ' ' A' ' 51' ' ' CYS . 46.4 m -52.07 -50.96 60.51 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 113.206 0.817 . . . . 0.0 113.206 -173.454 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.468 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.7 OUTLIER -72.18 -33.62 67.81 Favored 'General case' 0 N--CA 1.472 0.669 0 CA-C-O 119.366 -0.35 . . . . 0.0 111.112 177.734 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 2.6 t30 -57.4 -38.38 74.2 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 123.853 0.861 . . . . 0.0 111.849 174.116 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . . . . . . . . . 72.4 m95 -78.86 -27.42 44.11 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 -176.663 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.549 ' HA ' ' HG2' ' A' ' 63' ' ' LYS . 16.3 t60 -77.25 -30.06 54.29 Favored 'General case' 0 CA--C 1.557 1.239 0 C-N-CA 123.784 0.833 . . . . 0.0 109.151 178.521 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.497 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 94.9 mtp -69.05 -38.69 79.26 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 122.849 0.46 . . . . 0.0 110.426 176.719 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 26.5 mtpp -64.59 -28.48 69.66 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 115.557 -0.747 . . . . 0.0 112.175 176.036 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.549 ' HG2' ' HA ' ' A' ' 60' ' ' HIS . 28.9 mmmt -55.96 -36.54 67.93 Favored 'General case' 0 N--CA 1.487 1.379 0 C-N-CA 122.544 0.338 . . . . 0.0 111.371 170.285 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.497 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 92.3 m-70 -75.0 -19.03 60.26 Favored 'General case' 0 N--CA 1.495 1.825 0 C-N-CA 123.08 0.552 . . . . 0.0 111.539 176.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.0 t70 -91.94 -29.57 16.58 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 108.812 -0.811 . . . . 0.0 108.812 -172.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -99.25 -34.41 10.35 Favored 'General case' 0 C--O 1.238 0.464 0 CA-C-N 114.747 -1.115 . . . . 0.0 111.586 -175.835 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 30.7 t70 55.21 37.4 28.85 Favored 'General case' 0 N--CA 1.488 1.455 0 CA-C-O 123.178 1.466 . . . . 0.0 109.625 -165.377 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 62.8 p -62.31 -26.45 68.43 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-N 114.057 -1.429 . . . . 0.0 112.626 -179.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 56.8 t80 -73.99 -34.82 64.33 Favored 'General case' 0 C--O 1.245 0.848 0 C-N-CA 123.408 0.683 . . . . 0.0 111.083 -178.787 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . . . . . . . . . 96.4 m-85 48.35 79.43 0.07 Allowed 'General case' 0 N--CA 1.479 1.02 0 O-C-N 124.182 0.926 . . . . 0.0 110.161 -168.197 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -71.32 -46.85 59.66 Favored 'General case' 0 N--CA 1.479 0.978 0 CA-C-N 114.978 -1.01 . . . . 0.0 109.189 -175.346 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 55.8 m-85 -152.13 135.95 16.32 Favored 'General case' 0 N--CA 1.455 -0.221 0 N-CA-C 104.599 -2.371 . . . . 0.0 104.599 -179.819 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 44.4 p -157.42 119.07 3.7 Favored 'General case' 0 C--N 1.318 -0.777 0 C-N-CA 123.444 0.698 . . . . 0.0 109.248 -178.593 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 15.5 t -64.0 120.98 13.04 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.864 0.866 . . . . 0.0 109.417 172.067 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 62.5 t30 -57.39 -27.76 62.63 Favored 'General case' 0 CA--C 1.551 1.01 0 C-N-CA 123.34 0.656 . . . . 0.0 112.077 -177.308 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 6.1 mt -93.63 -39.35 10.69 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.132 0 N-CA-C 112.4 0.519 . . . . 0.0 112.4 -172.797 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.5 p -135.1 -1.56 2.63 Favored 'General case' 0 N--CA 1.493 1.696 0 CA-C-N 119.83 1.196 . . . . 0.0 113.095 -176.662 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 58.27 34.19 73.2 Favored Glycine 0 C--N 1.364 2.096 0 N-CA-C 114.624 0.61 . . . . 0.0 114.624 172.016 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.446 ' HB3' ' CE1' ' A' ' 81' ' ' PHE . 9.2 tmtt? -63.92 -39.57 94.48 Favored 'General case' 0 CA--C 1.56 1.349 0 N-CA-C 113.336 0.865 . . . . 0.0 113.336 -173.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . 0.424 ' HB2' ' O ' ' A' ' 79' ' ' LYS . 4.9 mptp? 80.55 119.74 0.05 Allowed 'General case' 0 N--CA 1.502 2.174 0 C-N-CA 124.914 1.285 . . . . 0.0 110.534 -174.717 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.446 ' CE1' ' HB3' ' A' ' 79' ' ' LYS . 79.2 m-85 -133.13 149.06 52.12 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.623 1.169 . . . . 0.0 108.648 176.017 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -63.11 -9.1 9.34 Favored 'General case' 0 N--CA 1.486 1.343 0 N-CA-C 114.503 1.297 . . . . 0.0 114.503 -174.044 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . 0.462 ' HG3' ' H ' ' A' ' 86' ' ' SER . 24.2 pttm -151.52 147.17 26.5 Favored 'General case' 0 C--O 1.24 0.594 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 173.013 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -60.42 -28.42 68.26 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.063 0.945 . . . . 0.0 110.689 176.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 2.3 m-20 -55.69 -42.21 74.85 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.621 0.769 . . . . 0.0 111.462 173.345 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.462 ' H ' ' HG3' ' A' ' 83' ' ' LYS . 75.4 m -71.11 -29.05 64.78 Favored 'General case' 0 C--O 1.214 -0.772 0 O-C-N 123.202 0.314 . . . . 0.0 111.156 176.324 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 71.3 t -72.55 -44.97 60.29 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 C-N-CA 123.834 0.854 . . . . 0.0 110.06 -176.075 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 87.3 t -72.73 -39.46 60.1 Favored 'Isoleucine or valine' 0 C--O 1.243 0.762 0 C-N-CA 124.73 1.212 . . . . 0.0 109.447 -178.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -66.35 -37.33 85.1 Favored 'General case' 0 C--N 1.35 0.619 0 CA-C-N 115.108 -0.951 . . . . 0.0 109.609 177.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 3.3 t60 -71.92 -32.2 67.13 Favored 'General case' 0 C--O 1.211 -0.973 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.723 178.111 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 22.7 ttpp -71.95 -38.75 69.74 Favored 'General case' 0 N--CA 1.472 0.633 0 CA-C-O 121.379 0.609 . . . . 0.0 109.583 -178.007 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.56 -17.77 59.95 Favored 'General case' 0 CA--C 1.545 0.763 0 CA-C-N 115.171 -0.922 . . . . 0.0 112.024 177.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 59.5 tptt -97.65 -45.65 6.3 Favored 'General case' 0 CA--C 1.552 1.025 0 C-N-CA 123.459 0.704 . . . . 0.0 111.591 -178.151 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 45.2 t -100.42 -14.93 18.11 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 124.712 1.205 . . . . 0.0 111.409 -168.761 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 37.8 m-70 -134.02 42.46 0.82 Allowed Pre-proline 0 CA--C 1.565 1.538 0 C-N-CA 123.826 0.85 . . . . 0.0 109.975 177.769 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -64.38 -29.28 62.92 Favored 'Trans proline' 0 C--N 1.387 2.597 0 C-N-CA 122.448 2.099 . . . . 0.0 113.885 -164.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 36.4 tt0 -140.36 97.86 3.31 Favored 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 108.346 -0.983 . . . . 0.0 108.346 172.474 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 85.2 t . . . . . 0 CA--C 1.552 1.037 0 C-N-CA 124.542 1.137 . . . . 0.0 109.517 176.879 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 80.3 m-70 . . . . . 0 N--CA 1.476 0.828 0 N-CA-C 110.149 -0.315 . . . . 0.0 110.149 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 27.1 ptt? -167.81 -38.67 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.066 0.946 . . . . 0.0 109.345 172.802 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 35.4 ttm180 -113.8 30.97 6.86 Favored 'General case' 0 N--CA 1.48 1.066 0 CA-C-O 122.367 1.079 . . . . 0.0 108.132 177.234 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.6 m-20 -120.75 80.99 1.7 Allowed 'General case' 0 C--O 1.235 0.332 0 CA-C-N 114.423 -1.262 . . . . 0.0 107.89 -169.251 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' TYR . . . . . . . . . . . . . 71.7 m-85 -78.84 118.38 20.82 Favored 'General case' 0 C--N 1.315 -0.924 0 CA-C-N 113.393 -1.731 . . . . 0.0 109.501 -176.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ILE . . . . . . . . . . . . . 40.2 mm -104.02 112.61 38.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.38 0 CA-C-N 115.859 -0.61 . . . . 0.0 109.755 -171.249 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' CYS . . . . . . . . . . . . . 40.5 t -59.99 101.43 0.12 Allowed 'General case' 0 N--CA 1.467 0.413 0 N-CA-C 109.311 -0.626 . . . . 0.0 109.311 161.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 31.48 -64.66 0.0 OUTLIER 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 128.32 2.648 . . . . 0.0 115.592 160.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . . . . . . . . . 4.2 t80 -125.04 -40.88 2.13 Favored 'General case' 0 N--CA 1.478 0.945 0 CA-C-N 114.911 -1.04 . . . . 0.0 111.009 -166.48 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -87.16 -46.21 9.97 Favored 'General case' 0 N--CA 1.484 1.275 0 CA-C-N 114.863 -1.062 . . . . 0.0 112.953 -163.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ALA . . . . . . . . . . . . . . . -66.82 127.16 31.42 Favored 'General case' 0 C--O 1.239 0.507 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -156.163 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ARG . . . . . . . . . . . . . 19.9 ptt180 -68.74 -62.38 1.41 Allowed 'General case' 0 CA--C 1.55 0.976 0 CA-C-N 114.743 -1.117 . . . . 0.0 108.105 161.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ALA . . . . . . . . . . . . . . . -168.25 126.89 1.18 Allowed 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.295 0.638 . . . . 0.0 110.833 164.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 89.1 m-85 -98.71 144.72 27.66 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 25.5 pttm -71.88 -19.28 61.97 Favored 'General case' 0 N--CA 1.477 0.895 0 N-CA-C 111.757 0.28 . . . . 0.0 111.757 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' SER . . . . . . . . . . . . . 40.6 t -143.66 144.3 31.82 Favored 'General case' 0 C--O 1.242 0.682 0 C-N-CA 123.586 0.754 . . . . 0.0 110.055 -175.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' SER . . . . . 0.424 ' HA ' HD23 ' A' ' 29' ' ' LEU . 20.3 p -58.0 -32.98 68.44 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 123.853 0.861 . . . . 0.0 111.113 168.908 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' HIS . . . . . 0.457 ' O ' HG23 ' A' ' 31' ' ' VAL . 24.4 m-70 -68.03 -38.24 82.29 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.545 0.738 . . . . 0.0 109.994 178.38 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -62.54 -49.45 75.24 Favored 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 124.136 0.974 . . . . 0.0 110.344 -179.815 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 26' ' ' SER . 0.5 OUTLIER -60.69 -36.59 79.15 Favored 'General case' 0 N--CA 1.477 0.892 0 CA-C-N 115.305 -0.861 . . . . 0.0 110.322 178.368 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -63.49 -30.88 71.93 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 124.534 1.146 . . . . 0.0 112.284 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.457 HG23 ' O ' ' A' ' 27' ' ' HIS . 48.3 t -66.45 -45.37 89.29 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.192 0 C-N-CA 123.146 0.578 . . . . 0.0 110.443 177.321 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -71.91 -33.66 68.47 Favored 'General case' 0 CA--C 1.547 0.851 0 C-N-CA 123.524 0.729 . . . . 0.0 109.903 177.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.532 ' HG3' ' HD2' ' A' ' 36' ' ' HIS . 57.6 ttt180 -63.05 -2.55 1.3 Allowed 'General case' 0 C--O 1.205 -1.27 0 C-N-CA 124.619 1.168 . . . . 0.0 112.226 -176.013 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' MET . . . . . . . . . . . . . 15.9 ptm -45.93 -11.6 0.02 OUTLIER 'General case' 0 N--CA 1.499 2.019 0 C-N-CA 126.241 1.817 . . . . 0.0 114.612 173.574 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.3 tp -83.75 -60.96 1.92 Allowed 'Isoleucine or valine' 0 CA--C 1.581 2.159 0 C-N-CA 124.934 1.294 . . . . 0.0 109.673 168.708 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . 0.532 ' HD2' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -103.24 9.85 37.96 Favored 'General case' 0 N--CA 1.515 2.809 0 N-CA-C 114.235 1.198 . . . . 0.0 114.235 -172.538 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' THR . . . . . . . . . . . . . 5.1 t -61.81 -56.59 17.8 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 114.532 1.308 . . . . 0.0 114.532 -167.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 86.19 -32.65 3.77 Favored Glycine 0 CA--C 1.53 1.017 0 C-N-CA 123.353 0.501 . . . . 0.0 112.388 -167.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 23.0 mm-40 -70.68 -46.56 62.96 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.706 0.802 . . . . 0.0 111.614 176.215 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LYS . . . . . . . . . . . . . 43.0 mtmt 70.7 94.96 0.05 OUTLIER Pre-proline 0 N--CA 1.476 0.864 0 C-N-CA 125.26 1.424 . . . . 0.0 110.934 176.963 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -71.14 -177.4 2.3 Favored 'Trans proline' 0 C--N 1.382 2.323 0 C-N-CA 122.512 2.141 . . . . 0.0 111.069 174.049 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 45.0 mt -110.38 109.26 19.6 Favored 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 123.254 0.622 . . . . 0.0 109.534 -170.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -113.28 146.29 39.62 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.626 0.77 . . . . 0.0 109.248 -178.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.554 ' SG ' ' HB ' ' A' ' 46' ' ' ILE . 4.3 t -64.35 108.49 1.63 Allowed 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 123.635 0.774 . . . . 0.0 110.177 171.83 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -67.37 4.78 0.9 Allowed 'General case' 0 CA--C 1.557 1.226 0 N-CA-C 114.369 1.248 . . . . 0.0 114.369 178.711 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.554 ' HB ' ' SG ' ' A' ' 44' ' ' CYS . 36.6 mm -95.23 -54.73 6.81 Favored 'Isoleucine or valine' 0 C--N 1.346 0.441 0 N-CA-C 108.186 -1.042 . . . . 0.0 108.186 -177.465 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' CYS . . . . . 0.527 ' SG ' ' N ' ' A' ' 48' ' ' GLY . 19.6 p -120.47 -110.94 0.34 Allowed 'General case' 0 N--CA 1.443 -0.814 0 N-CA-C 103.786 -2.672 . . . . 0.0 103.786 175.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . 0.527 ' N ' ' SG ' ' A' ' 47' ' ' CYS . . . -147.23 164.33 28.66 Favored Glycine 0 N--CA 1.446 -0.646 0 N-CA-C 108.798 -1.721 . . . . 0.0 108.798 156.705 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 63.4 t80 171.24 110.22 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.463 0 N-CA-C 102.449 -3.167 . . . . 0.0 102.449 -179.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' THR . . . . . . . . . . . . . 4.1 m -116.65 132.44 56.68 Favored 'General case' 0 C--O 1.237 0.398 0 CA-C-O 121.79 0.805 . . . . 0.0 109.446 -164.396 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' CYS . . . . . . . . . . . . . 42.1 t -152.54 166.19 32.79 Favored 'General case' 0 C--N 1.308 -1.199 0 CA-C-N 113.81 -1.541 . . . . 0.0 109.317 -173.927 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ARG . . . . . . . . . . . . . 14.2 ptt180 -100.37 -6.74 25.3 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.071 0.549 . . . . 0.0 110.37 175.458 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.608 HE21 ' HB3' ' A' ' 55' ' ' ALA . 51.9 tt0 -113.21 112.3 23.53 Favored 'General case' 0 C--O 1.239 0.521 0 C-N-CA 124.396 1.078 . . . . 0.0 109.249 -175.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -51.95 -38.01 54.97 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.691 0.797 . . . . 0.0 112.537 -179.696 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.608 ' HB3' HE21 ' A' ' 53' ' ' GLN . . . -59.64 -39.06 83.08 Favored 'General case' 0 N--CA 1.482 1.14 0 O-C-N 123.979 0.799 . . . . 0.0 112.364 -178.337 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' SER . . . . . . . . . . . . . 23.3 t -59.28 -54.98 40.65 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.293 0.637 . . . . 0.0 111.395 -176.16 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LEU . . . . . 0.504 ' H ' HD23 ' A' ' 57' ' ' LEU . 0.6 OUTLIER -76.58 -29.5 56.64 Favored 'General case' 0 N--CA 1.474 0.751 0 C-N-CA 123.057 0.543 . . . . 0.0 112.183 178.362 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASN . . . . . . . . . . . . . 64.6 t30 -53.82 -37.18 63.31 Favored 'General case' 0 N--CA 1.493 1.686 0 C-N-CA 123.583 0.753 . . . . 0.0 112.781 178.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' TRP . . . . . 0.445 ' O ' ' HG3' ' A' ' 63' ' ' LYS . 95.7 m95 -80.55 -47.34 14.34 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 175.281 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' HIS . . . . . 0.439 ' HB3' ' HA ' ' A' ' 57' ' ' LEU . 72.7 t60 -45.45 -42.49 10.55 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 114.713 1.375 . . . . 0.0 114.713 175.565 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' MET . . . . . 0.5 ' HA ' ' HD2' ' A' ' 64' ' ' HIS . 26.0 ptm -67.2 -38.74 85.85 Favored 'General case' 0 N--CA 1.491 1.607 0 CA-C-N 118.524 0.602 . . . . 0.0 112.4 174.916 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -63.33 -30.47 71.6 Favored 'General case' 0 N--CA 1.489 1.479 0 C-N-CA 123.309 0.644 . . . . 0.0 111.3 172.233 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.514 ' HG2' ' HB2' ' A' ' 70' ' ' TYR . 95.4 mttt -66.6 -28.6 68.63 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.258 0.623 . . . . 0.0 111.253 177.116 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' HIS . . . . . 0.5 ' HD2' ' HA ' ' A' ' 61' ' ' MET . 76.6 m-70 -66.19 -22.59 66.35 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.395 0.678 . . . . 0.0 111.166 174.824 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 21.1 t70 -66.05 -56.28 12.36 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.924 0.49 . . . . 0.0 110.036 -174.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -81.76 -8.87 59.74 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.215 0.606 . . . . 0.0 112.233 171.485 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 20.0 t70 72.48 -59.76 0.55 Allowed 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 126.025 1.73 . . . . 0.0 113.193 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 45.3 t -66.8 -67.66 0.43 Allowed 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 124.863 1.265 . . . . 0.0 113.916 -166.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PHE . . . . . . . . . . . . . 43.0 m-85 -138.39 9.24 2.69 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.071 0.948 . . . . 0.0 109.949 -169.887 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' TYR . . . . . 0.514 ' HB2' ' HG2' ' A' ' 63' ' ' LYS . 40.4 t80 68.28 9.14 7.05 Favored 'General case' 0 N--CA 1.49 1.527 0 C-N-CA 124.06 0.944 . . . . 0.0 110.53 -164.405 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLN . . . . . . . . . . . . . 69.7 mt-30 -108.8 -115.69 0.29 Allowed 'General case' 0 CA--C 1.55 0.955 0 C-N-CA 123.803 0.841 . . . . 0.0 110.262 -176.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 91.3 m-85 -145.93 138.6 25.65 Favored 'General case' 0 C--N 1.356 0.854 0 N-CA-C 107.768 -1.197 . . . . 0.0 107.768 -166.148 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' SER . . . . . . . . . . . . . 36.7 m -133.33 158.59 42.6 Favored 'General case' 0 C--N 1.316 -0.888 0 C-N-CA 124.319 1.048 . . . . 0.0 110.281 -176.286 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' CYS . . . . . . . . . . . . . 16.5 t -97.71 116.26 29.59 Favored 'General case' 0 C--O 1.22 -0.495 0 N-CA-C 106.574 -1.639 . . . . 0.0 106.574 167.478 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -64.96 -19.54 66.02 Favored 'General case' 0 CA--C 1.554 1.134 0 CA-C-N 118.307 0.503 . . . . 0.0 111.763 179.915 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' ILE . . . . . . . . . . . . . 3.0 mt -86.62 -40.03 13.81 Favored 'Isoleucine or valine' 0 CA--C 1.555 1.159 0 C-N-CA 123.233 0.613 . . . . 0.0 111.683 -174.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' CYS . . . . . . . . . . . . . 17.9 p -141.08 -0.88 1.42 Allowed 'General case' 0 N--CA 1.494 1.745 0 N-CA-C 113.474 0.916 . . . . 0.0 113.474 -178.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 60.54 40.65 98.08 Favored Glycine 0 C--N 1.347 1.159 0 N-CA-C 114.444 0.538 . . . . 0.0 114.444 174.974 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LYS . . . . . 0.415 ' HB3' ' CE2' ' A' ' 81' ' ' PHE . 5.9 tmtt? -66.36 -28.98 69.07 Favored 'General case' 0 CA--C 1.569 1.693 0 C-N-CA 123.401 0.68 . . . . 0.0 112.051 -179.823 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' LYS . . . . . . . . . . . . . 71.1 mmtt 71.42 110.53 0.06 Allowed 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 125.316 1.446 . . . . 0.0 111.037 172.637 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' PHE . . . . . 0.415 ' CE2' ' HB3' ' A' ' 79' ' ' LYS . 97.1 m-85 -120.38 164.64 16.05 Favored 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 113.726 1.01 . . . . 0.0 113.726 -172.027 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 12.9 tp10 -67.99 -35.55 78.53 Favored 'General case' 0 C--N 1.351 0.646 0 CA-C-N 114.649 -1.159 . . . . 0.0 113.027 176.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -151.87 170.54 19.57 Favored 'General case' 0 N--CA 1.477 0.896 0 CA-C-N 117.93 0.332 . . . . 0.0 111.633 175.704 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' LYS . . . . . . . . . . . . . 2.7 mmmp? -57.47 -40.0 77.6 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.839 1.255 . . . . 0.0 110.913 179.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' ASP . . . . . . . . . . . . . 19.8 t70 -54.35 -44.47 72.19 Favored 'General case' 0 N--CA 1.485 1.286 0 O-C-N 123.571 0.545 . . . . 0.0 111.228 179.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . . . . . . . . . 27.5 m -63.78 -34.84 78.81 Favored 'General case' 0 CA--C 1.546 0.82 0 O-C-N 123.513 0.508 . . . . 0.0 111.742 178.777 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' VAL . . . . . . . . . . . . . 13.3 t -75.79 -41.49 40.06 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.339 0 C-N-CA 123.424 0.69 . . . . 0.0 110.251 -175.099 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' VAL . . . . . . . . . . . . . 89.1 t -72.42 -38.6 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.094 0 C-N-CA 124.877 1.271 . . . . 0.0 109.038 -176.705 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' ALA . . . . . . . . . . . . . . . -64.46 -41.2 96.67 Favored 'General case' 0 C--N 1.349 0.579 0 CA-C-N 115.159 -0.928 . . . . 0.0 109.139 176.258 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' HIS . . . . . . . . . . . . . 14.1 t60 -71.9 -31.56 66.53 Favored 'General case' 0 CA--C 1.544 0.741 0 CA-C-N 114.368 -1.287 . . . . 0.0 111.952 -178.891 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 40.1 ttmt -71.88 -45.23 62.04 Favored 'General case' 0 N--CA 1.482 1.131 0 N-CA-C 109.438 -0.579 . . . . 0.0 109.438 179.821 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -62.21 -33.19 74.09 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 114.577 -1.192 . . . . 0.0 111.013 179.118 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . . . . . . . . . 58.8 tttm -92.38 -47.63 7.08 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.533 0.733 . . . . 0.0 111.528 -172.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' SER . . . . . . . . . . . . . 26.7 t -102.94 -7.46 21.47 Favored 'General case' 0 CA--C 1.544 0.724 0 C-N-CA 123.616 0.766 . . . . 0.0 111.918 -168.728 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' HIS . . . . . . . . . . . . . 73.4 m-70 -134.63 42.69 0.82 Allowed Pre-proline 0 CA--C 1.567 1.632 0 N-CA-C 113.084 0.772 . . . . 0.0 113.084 177.609 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' PRO . . . . . . . . . . . . . 60.4 Cg_endo -72.17 -32.75 10.26 Favored 'Trans proline' 0 C--N 1.391 2.768 0 CA-C-N 121.407 1.538 . . . . 0.0 110.788 177.414 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 18.1 mm-40 -117.39 97.17 5.75 Favored 'General case' 0 C--N 1.348 0.522 0 N-CA-C 106.981 -1.489 . . . . 0.0 106.981 170.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' VAL . . . . . . . . . . . . . 2.6 p . . . . . 0 C--O 1.251 1.154 0 C-N-CA 123.993 0.917 . . . . 0.0 108.765 174.236 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_